CAS RN: 118443-89-3
CAS Name: (6R,7R)-7-[[(2Z)-2-(2-amino-4-thiazolyl)-2-methoxyimino-1-oxoethyl]amino]-8-oxo-3-(5,6,7,8-tetrahydroquinolin-1-ium-1-ylmethyl)-5-thia-1-azabicyclo[4.2.0]oct-2-ene-2-carboxylic acid; sulfuric acid
OPENEYE Name: (6R,7R)-7-[[(2Z)-2-(2-aminothiazol-4-yl)-2-methoxyimino-acetyl]amino]-8-oxo-3-(5,6,7,8-tetrahydroquinolin-1-ium-1-ylmethyl)-5-thia-1-azabicyclo[4.2.0]oct-2-ene-2-carboxylic acid; sulfuric acid
IUPAC Name: (6R,7R)-7-[[(2Z)-2-(2-amino-1,3-thiazol-4-yl)-2-methoxyiminoacetyl]amino]-8-oxo-3-(5,6,7,8-tetrahydroquinolin-1-ium-1-ylmethyl)-5-thia-1-azabicyclo[4.2.0]oct-2-ene-2-carboxylic acid; sulfuric acid
SYSTEMATIC NAME: (6R,7R)-7-[[(2Z)-2-(2-azanyl-1,3-thiazol-4-yl)-2-methoxyimino-ethanoyl]amino]-8-oxidanylidene-3-(5,6,7,8-tetrahydroquinolin-1-ium-1-ylmethyl)-5-thia-1-azabicyclo[4.2.0]oct-2-ene-2-carboxylic acid; sulfuric acid
MOLECULAR FORMULA: C23H27N6O9S3+
MOLECULAR WEIGHT: 627.69028
SMILES: CO/N=C(/C1=CSC(=N1)N)\C(=O)N[C@H]2[C@@H]3N(C2=O)C(=C(CS3)C[N+]4=CC=CC5=C4CCCC5)C(=O)O.OS(=O)(=O)O
Structure:
CAS RN: 55028-72-3
CAS Name: sodium (Z)-7-[(1S,2S,3S,5R)-2-[(E,3S)-4-(3-chlorophenoxy)-3-hydroxybut-1-enyl]-3,5-dihydroxycyclopentyl]-5-heptenoate
OPENEYE Name: sodium (Z)-7-[(1S,2S,3S,5R)-2-[(E,3S)-4-(3-chlorophenoxy)-3-hydroxy-but-1-enyl]-3,5-dihydroxy-cyclopentyl]hept-5-enoate
IUPAC Name: sodium (Z)-7-[(1S,2S,3S,5R)-2-[(E,3S)-4-(3-chlorophenoxy)-3-hydroxybut-1-enyl]-3,5-dihydroxycyclopentyl]hept-5-enoate
SYSTEMATIC NAME: sodium (Z)-7-[(1S,2S,3S,5R)-2-[(E,3S)-4-(3-chloranylphenoxy)-3-oxidanyl-but-1-enyl]-3,5-bis(oxidanyl)cyclopentyl]hept-5-enoate
MOLECULAR FORMULA: C22H28ClNaO6
MOLECULAR WEIGHT: 446.89689
SMILES: C1[C@H]([C@H]([C@@H]([C@H]1O)/C=C/[C@@H](COC2=CC(=CC=C2)Cl)O)C/C=C\CCCC(=O)[O-])O.[Na+]
Structure:
CAS RN: 88641-36-5
CAS Name: sodium (6R,7S)-7-[[2-[(2-amino-2-carboxyethyl)thio]-1-oxoethyl]amino]-7-methoxy-3-[[(1-methyl-5-tetrazolyl)thio]methyl]-8-oxo-5-thia-1-azabicyclo[4.2.0]oct-2-ene-2-carboxylate heptahydrate
OPENEYE Name: sodium (6R,7S)-7-[[2-(2-amino-2-carboxy-ethyl)sulfanylacetyl]amino]-7-methoxy-3-[(1-methyltetrazol-5-yl)sulfanylmethyl]-8-oxo-5-thia-1-azabicyclo[4.2.0]oct-2-ene-2-carboxylate heptahydrate
IUPAC Name: sodium (6R,7S)-7-[[2-(2-amino-2-carboxyethyl)sulfanylacetyl]amino]-7-methoxy-3-[(1-methyltetrazol-5-yl)sulfanylmethyl]-8-oxo-5-thia-1-azabicyclo[4.2.0]oct-2-ene-2-carboxylate heptahydrate
SYSTEMATIC NAME: sodium (6R,7S)-7-[2-(2-azanyl-3-oxidanyl-3-oxidanylidene-propyl)sulfanylethanoylamino]-7-methoxy-3-[(1-methyl-1,2,3,4-tetrazol-5-yl)sulfanylmethyl]-8-oxidanylidene-5-thia-1-azabicyclo[4.2.0]oct-2-ene-2-carboxylate heptahydrate
MOLECULAR FORMULA: C16H34N7NaO14S3
MOLECULAR WEIGHT: 667.66443
SMILES: CN1C(=NN=N1)SCC2=C(N3[C@@H]([C@@](C3=O)(NC(=O)CSCC(C(=O)O)N)OC)SC2)C(=O)[O-].O.O.O.O.O.O.O.[Na+]
Structure:
CAS RN: 51460-26-5
CAS Name: sodium (5Z)-5-(carbamoylhydrazinylidene)-1-methyl-6-oxo-2,3-dihydroindole-2-sulfonate trihydrate
OPENEYE Name: sodium (5Z)-5-(carbamoylhydrazono)-1-methyl-6-oxo-2,3-dihydroindole-2-sulfonate trihydrate
IUPAC Name: sodium (5Z)-5-(carbamoylhydrazinylidene)-1-methyl-6-oxo-2,3-dihydroindole-2-sulfonate trihydrate
SYSTEMATIC NAME: sodium (5Z)-5-(aminocarbonylhydrazinylidene)-1-methyl-6-oxidanylidene-2,3-dihydroindole-2-sulfonate trihydrate
MOLECULAR FORMULA: C10H17N4NaO8S
MOLECULAR WEIGHT: 376.31875
SMILES: CN1C(CC2=C/C(=N/NC(=O)N)/C(=O)C=C21)S(=O)(=O)[O-].O.O.O.[Na+]
Structure:
CAS RN: 72010-19-6
CAS Name: (Z)-2-propyl-3-pentenoic acid
OPENEYE Name: (Z)-2-propylpent-3-enoic acid
IUPAC Name: (Z)-2-propylpent-3-enoic acid
SYSTEMATIC NAME: (Z)-2-propylpent-3-enoic acid
MOLECULAR FORMULA: C8H14O2
MOLECULAR WEIGHT: 142.19556
SMILES: CCCC(/C=C\C)C(=O)O
Structure:
CAS RN: 13422-51-0
CAS Name: cobalt(2+); [(2R,3S,4R,5S)-5-(5,6-dimethyl-1-benzimidazolyl)-4-hydroxy-2-(hydroxymethyl)-3-oxolanyl] [(2R)-1-[[1-oxo-3-[(2R,3R,4Z,7S,9Z,12S,13S,14Z,17S,18S,19R)-2,13,18-tris(2-amino-2-oxoethyl)-7,12,17-tris(3-amino-3-oxopropyl)-3,5,8,8,13,15,18,19-octamet
OPENEYE Name: cobaltous [(2R,3S,4R,5S)-5-(5,6-dimethylbenzimidazol-1-yl)-4-hydroxy-2-(hydroxymethyl)tetrahydrofuran-3-yl] [(1R)-1-methyl-2-[3-[(2R,3R,4Z,7S,9Z,12S,13S,14Z,17S,18S,19R)-2,13,18-tris(2-amino-2-oxo-ethyl)-7,12,17-tris(3-amino-3-oxo-propyl)-3,5,8,8,13,15,18
IUPAC Name: cobalt(2+); [(2R,3S,4R,5S)-5-(5,6-dimethylbenzimidazol-1-yl)-4-hydroxy-2-(hydroxymethyl)oxolan-3-yl] [(2R)-1-[3-[(2R,3R,4Z,7S,9Z,12S,13S,14Z,17S,18S,19R)-2,13,18-tris(2-amino-2-oxoethyl)-7,12,17-tris(3-amino-3-oxopropyl)-3,5,8,8,13,15,18,19-octamethyl-2,7
SYSTEMATIC NAME: cobalt(2+); [(2R,3S,4R,5S)-5-(5,6-dimethylbenzimidazol-1-yl)-2-(hydroxymethyl)-4-oxidanyl-oxolan-3-yl] [(2R)-1-[3-[(2R,3R,4Z,7S,9Z,12S,13S,14Z,17S,18S,19R)-2,13,18-tris(2-azanyl-2-oxidanylidene-ethyl)-7,12,17-tris(3-azanyl-3-oxidanylidene-propyl)-3,5,8,8,
MOLECULAR FORMULA: C62H90CoN13O15P
MOLECULAR WEIGHT: 1347.363061
SMILES: CC1=CC2=C(C=C1C)N(C=N2)[C@@H]3[C@@H]([C@@H]([C@H](O3)CO)OP(=O)([O-])O[C@H](C)CNC(=O)CC[C@@]\4([C@H](C5[C@]6([C@@]([C@@H](C(=N6)/C(=C\7/[C@@]([C@@H](C(=N7)/C=C\8/C([C@@H](C(=N8)/C(=C4\[N-]5)/C)CCC(=O)N)(C)C)CCC(=O)N)(C)CC(=O)N)/C)CCC(=O)N)(C)CC(=O)N)C)CC(=
Structure:
CAS RN: 73145-13-8
CAS Name:
OPENEYE Name:
IUPAC Name:
SYSTEMATIC NAME:
MOLECULAR FORMULA: C42H51N6NiO13+
MOLECULAR WEIGHT: 906.58014
SMILES: C[C@@]12CC(=O)N[C@@]13C[C@H]4[C@H]([C@](C(=N4)C[C@@H]5[C@H]([C@@H]6CCC(=O)/C(=C/7\[C@H]([C@@H](/C(=C/C(=N3)[C@H]2CCC(=O)O)/[N-]7)CC(=O)O)CCC(=O)O)/C6=N5)CC(=O)O)(C)CC(=O)N)CCC(=O)O.[Ni+2]
Structure:
CAS RN: 68-19-9
CAS Name: cobalt(3+); [(2R,3S,4R,5S)-5-(5,6-dimethyl-1-benzimidazolyl)-4-hydroxy-2-(hydroxymethyl)-3-oxolanyl] [(2R)-1-[[1-oxo-3-[(2R,3R,4Z,7S,9Z,12S,13S,14Z,17S,18S,19R)-2,13,18-tris(2-amino-2-oxoethyl)-7,12,17-tris(3-amino-3-oxopropyl)-3,5,8,8,13,15,18,19-octamet
OPENEYE Name: cobaltic [(2R,3S,4R,5S)-5-(5,6-dimethylbenzimidazol-1-yl)-4-hydroxy-2-(hydroxymethyl)tetrahydrofuran-3-yl] [(1R)-1-methyl-2-[3-[(2R,3R,4Z,7S,9Z,12S,13S,14Z,17S,18S,19R)-2,13,18-tris(2-amino-2-oxo-ethyl)-7,12,17-tris(3-amino-3-oxo-propyl)-3,5,8,8,13,15,18,
IUPAC Name: cobalt(3+); [(2R,3S,4R,5S)-5-(5,6-dimethylbenzimidazol-1-yl)-4-hydroxy-2-(hydroxymethyl)oxolan-3-yl] [(2R)-1-[3-[(2R,3R,4Z,7S,9Z,12S,13S,14Z,17S,18S,19R)-2,13,18-tris(2-amino-2-oxoethyl)-7,12,17-tris(3-amino-3-oxopropyl)-3,5,8,8,13,15,18,19-octamethyl-2,7
SYSTEMATIC NAME: cobalt(3+); [(2R,3S,4R,5S)-5-(5,6-dimethylbenzimidazol-1-yl)-2-(hydroxymethyl)-4-oxidanyl-oxolan-3-yl] [(2R)-1-[3-[(2R,3R,4Z,7S,9Z,12S,13S,14Z,17S,18S,19R)-2,13,18-tris(2-azanyl-2-oxidanylidene-ethyl)-7,12,17-tris(3-azanyl-3-oxidanylidene-propyl)-3,5,8,8,
MOLECULAR FORMULA: C63H88CoN14O14P
MOLECULAR WEIGHT: 1355.365181
SMILES: CC1=CC2=C(C=C1C)N(C=N2)[C@@H]3[C@@H]([C@@H]([C@H](O3)CO)OP(=O)([O-])O[C@H](C)CNC(=O)CC[C@@]\4([C@H](C5[C@]6([C@@]([C@@H](C(=N6)/C(=C\7/[C@@]([C@@H](C(=N7)/C=C\8/C([C@@H](C(=N8)/C(=C4\[N-]5)/C)CCC(=O)N)(C)C)CCC(=O)N)(C)CC(=O)N)/C)CCC(=O)N)(C)CC(=O)N)C)CC(=
Structure:
CAS RN: 76081-94-2
CAS Name: (2S,3S,4S,5S,6R)-2-[[(2R,3S,4R,5R,6S)-6-[[(2R,3S,4R,5S,6S)-4,5-dihydroxy-2-(hydroxymethyl)-6-[[(2R,4R,5S,6R)-4,5,6-trihydroxy-2-(hydroxymethyl)-3-oxanyl]oxy]-3-oxanyl]oxy]-4,5-dihydroxy-2-(hydroxymethyl)-3-oxanyl]oxy]-6-(hydroxymethyl)oxane-3,4,5-triol
OPENEYE Name: (2S,3S,4S,5S,6R)-2-[(2R,3S,4R,5R,6S)-6-[(2R,3S,4R,5S,6S)-4,5-dihydroxy-2-(hydroxymethyl)-6-[(2R,4R,5S,6R)-4,5,6-trihydroxy-2-(hydroxymethyl)tetrahydropyran-3-yl]oxy-tetrahydropyran-3-yl]oxy-4,5-dihydroxy-2-(hydroxymethyl)tetrahydropyran-3-yl]oxy-6-(hydrox
IUPAC Name: (2S,3S,4S,5S,6R)-2-[(2R,3S,4R,5R,6S)-6-[(2R,3S,4R,5S,6S)-4,5-dihydroxy-2-(hydroxymethyl)-6-[(2R,4R,5S,6R)-4,5,6-trihydroxy-2-(hydroxymethyl)oxan-3-yl]oxyoxan-3-yl]oxy-4,5-dihydroxy-2-(hydroxymethyl)oxan-3-yl]oxy-6-(hydroxymethyl)oxane-3,4,5-triol
SYSTEMATIC NAME: (2R,3S,4S,5S,6S)-2-(hydroxymethyl)-6-[(2R,3S,4R,5R,6S)-2-(hydroxymethyl)-6-[(2R,3S,4R,5S,6S)-2-(hydroxymethyl)-6-[(2R,4R,5S,6R)-2-(hydroxymethyl)-4,5,6-tris(oxidanyl)oxan-3-yl]oxy-4,5-bis(oxidanyl)oxan-3-yl]oxy-4,5-bis(oxidanyl)oxan-3-yl]oxy-oxane-3,4,5-t
MOLECULAR FORMULA: C24H42O21
MOLECULAR WEIGHT: 666.57768
SMILES: C([C@@H]1[C@H]([C@@H]([C@@H]([C@@H](O1)O[C@@H]2[C@H](O[C@H]([C@@H]([C@H]2O)O)O[C@@H]3[C@H](O[C@H]([C@H]([C@H]3O)O)OC4[C@H](O[C@H]([C@H]([C@H]4O)O)O)CO)CO)CO)O)O)O)O
Structure:
CAS RN: 11078-31-2
CAS Name: (2S,3S,4S,5S,6R)-2-[[(2R,3S,4R,5R,6S)-6-[[(2R,3S,4R,5S,6S)-4,5-dihydroxy-2-(hydroxymethyl)-6-[[(2R,4R,5S,6R)-4,5,6-trihydroxy-2-(hydroxymethyl)-3-oxanyl]oxy]-3-oxanyl]oxy]-4,5-dihydroxy-2-(hydroxymethyl)-3-oxanyl]oxy]-6-(hydroxymethyl)oxane-3,4,5-triol
OPENEYE Name: (2S,3S,4S,5S,6R)-2-[(2R,3S,4R,5R,6S)-6-[(2R,3S,4R,5S,6S)-4,5-dihydroxy-2-(hydroxymethyl)-6-[(2R,4R,5S,6R)-4,5,6-trihydroxy-2-(hydroxymethyl)tetrahydropyran-3-yl]oxy-tetrahydropyran-3-yl]oxy-4,5-dihydroxy-2-(hydroxymethyl)tetrahydropyran-3-yl]oxy-6-(hydrox
IUPAC Name: (2S,3S,4S,5S,6R)-2-[(2R,3S,4R,5R,6S)-6-[(2R,3S,4R,5S,6S)-4,5-dihydroxy-2-(hydroxymethyl)-6-[(2R,4R,5S,6R)-4,5,6-trihydroxy-2-(hydroxymethyl)oxan-3-yl]oxyoxan-3-yl]oxy-4,5-dihydroxy-2-(hydroxymethyl)oxan-3-yl]oxy-6-(hydroxymethyl)oxane-3,4,5-triol
SYSTEMATIC NAME: (2R,3S,4S,5S,6S)-2-(hydroxymethyl)-6-[(2R,3S,4R,5R,6S)-2-(hydroxymethyl)-6-[(2R,3S,4R,5S,6S)-2-(hydroxymethyl)-6-[(2R,4R,5S,6R)-2-(hydroxymethyl)-4,5,6-tris(oxidanyl)oxan-3-yl]oxy-4,5-bis(oxidanyl)oxan-3-yl]oxy-4,5-bis(oxidanyl)oxan-3-yl]oxy-oxane-3,4,5-t
MOLECULAR FORMULA: C24H42O21
MOLECULAR WEIGHT: 666.57768
SMILES: C([C@@H]1[C@H]([C@@H]([C@@H]([C@@H](O1)O[C@@H]2[C@H](O[C@H]([C@@H]([C@H]2O)O)O[C@@H]3[C@H](O[C@H]([C@H]([C@H]3O)O)OC4[C@H](O[C@H]([C@H]([C@H]4O)O)O)CO)CO)CO)O)O)O)O
Structure:
CAS RN: 13422-52-1
CAS Name: cobalt(2+); [(2R,3S,4R,5S)-5-(5,6-dimethyl-1-benzimidazolyl)-4-hydroxy-2-(hydroxymethyl)-3-oxolanyl] [(2R)-1-[[1-oxo-3-[(2R,3R,4Z,7S,9Z,12S,13S,14Z,17S,18S,19R)-2,13,18-tris(2-amino-2-oxoethyl)-7,12,17-tris(3-amino-3-oxopropyl)-3,5,8,8,13,15,18,19-octamet
OPENEYE Name: cobaltous [(2R,3S,4R,5S)-5-(5,6-dimethylbenzimidazol-1-yl)-4-hydroxy-2-(hydroxymethyl)tetrahydrofuran-3-yl] [(1R)-1-methyl-2-[3-[(2R,3R,4Z,7S,9Z,12S,13S,14Z,17S,18S,19R)-2,13,18-tris(2-amino-2-oxo-ethyl)-7,12,17-tris(3-amino-3-oxo-propyl)-3,5,8,8,13,15,18
IUPAC Name: cobalt(2+); [(2R,3S,4R,5S)-5-(5,6-dimethylbenzimidazol-1-yl)-4-hydroxy-2-(hydroxymethyl)oxolan-3-yl] [(2R)-1-[3-[(2R,3R,4Z,7S,9Z,12S,13S,14Z,17S,18S,19R)-2,13,18-tris(2-amino-2-oxoethyl)-7,12,17-tris(3-amino-3-oxopropyl)-3,5,8,8,13,15,18,19-octamethyl-2,7
SYSTEMATIC NAME: cobalt(2+); [(2R,3S,4R,5S)-5-(5,6-dimethylbenzimidazol-1-yl)-2-(hydroxymethyl)-4-oxidanyl-oxolan-3-yl] [(2R)-1-[3-[(2R,3R,4Z,7S,9Z,12S,13S,14Z,17S,18S,19R)-2,13,18-tris(2-azanyl-2-oxidanylidene-ethyl)-7,12,17-tris(3-azanyl-3-oxidanylidene-propyl)-3,5,8,8,
MOLECULAR FORMULA: C62H91CoN13O15P+
MOLECULAR WEIGHT: 1348.371001
SMILES: CC1=CC2=C(C=C1C)N(C=N2)[C@@H]3[C@@H]([C@@H]([C@H](O3)CO)OP(=O)(O)O[C@H](C)CNC(=O)CC[C@@]\4([C@H](C5[C@]6([C@@]([C@@H](C(=N6)/C(=C\7/[C@@]([C@@H](C(=N7)/C=C\8/C([C@@H](C(=N8)/C(=C4\[N-]5)/C)CCC(=O)N)(C)C)CCC(=O)N)(C)CC(=O)N)/C)CCC(=O)N)(C)CC(=O)N)C)CC(=O)N
Structure:
CAS RN: 14709-02-5
CAS Name: cobalt(3+); [(2R,3S,4R,5S)-4,5-dihydroxy-2-(hydroxymethyl)-3-oxolanyl] [(2R)-1-[[1-oxo-3-[(2R,3R,4Z,7S,9Z,12S,13S,14Z,17S,18S,19R)-2,13,18-tris(2-amino-2-oxoethyl)-7,12,17-tris(3-amino-3-oxopropyl)-3,5,8,8,13,15,18,19-octamethyl-2,7,12,17-tetrahydro-1H-co
OPENEYE Name: cobaltic [(2R,3S,4R,5S)-4,5-dihydroxy-2-(hydroxymethyl)tetrahydrofuran-3-yl] [(1R)-1-methyl-2-[3-[(2R,3R,4Z,7S,9Z,12S,13S,14Z,17S,18S,19R)-2,13,18-tris(2-amino-2-oxo-ethyl)-7,12,17-tris(3-amino-3-oxo-propyl)-3,5,8,8,13,15,18,19-octamethyl-2,7,12,17-tetrah
IUPAC Name: cobalt(3+); [(2R,3S,4R,5S)-4,5-dihydroxy-2-(hydroxymethyl)oxolan-3-yl] [(2R)-1-[3-[(2R,3R,4Z,7S,9Z,12S,13S,14Z,17S,18S,19R)-2,13,18-tris(2-amino-2-oxoethyl)-7,12,17-tris(3-amino-3-oxopropyl)-3,5,8,8,13,15,18,19-octamethyl-2,7,12,17-tetrahydro-1H-corrin-21
SYSTEMATIC NAME: cobalt(3+); [(2R,3S,4R,5S)-2-(hydroxymethyl)-4,5-bis(oxidanyl)oxolan-3-yl] [(2R)-1-[3-[(2R,3R,4Z,7S,9Z,12S,13S,14Z,17S,18S,19R)-2,13,18-tris(2-azanyl-2-oxidanylidene-ethyl)-7,12,17-tris(3-azanyl-3-oxidanylidene-propyl)-3,5,8,8,13,15,18,19-octamethyl-2,7,1
MOLECULAR FORMULA: C53H81CoN11O15P+2
MOLECULAR WEIGHT: 1202.181901
SMILES: C/C/1=C/2\[C@@]([C@@H](C(=N2)/C=C\3/C([C@@H](C(=N3)/C(=C\4/[C@]([C@H](C([N-]4)[C@]5([C@@]([C@@H](C1=N5)CCC(=O)N)(C)CC(=O)N)C)CC(=O)N)(C)CCC(=O)NC[C@@H](C)OP(=O)(O)O[C@@H]6[C@H](O[C@@H]([C@@H]6O)O)CO)/C)CCC(=O)N)(C)C)CCC(=O)N)(C)CC(=O)N.[Co+3]
Structure:
CAS RN: 12698-55-4
CAS Name: [(6Z,10E,14E)-3,7,11,15,19-pentamethyleicosa-6,10,14,18-tetraenyl] dihydrogen phosphate
OPENEYE Name: [(6Z,10E,14E)-3,7,11,15,19-pentamethylicosa-6,10,14,18-tetraenyl] dihydrogen phosphate
IUPAC Name: [(6Z,10E,14E)-3,7,11,15,19-pentamethylicosa-6,10,14,18-tetraenyl] dihydrogen phosphate
SYSTEMATIC NAME: [(6Z,10E,14E)-3,7,11,15,19-pentamethylicosa-6,10,14,18-tetraenyl] dihydrogen phosphate
MOLECULAR FORMULA: C25H45O4P
MOLECULAR WEIGHT: 440.596161
SMILES: CC(CC/C=C(/C)\CC/C=C(\C)/CC/C=C(\C)/CCC=C(C)C)CCOP(=O)(O)O
Structure:
CAS RN: 68553-60-6
CAS Name: 2-naphthalenecarboxylate; vanadium(4+)
OPENEYE Name: naphthalene-2-carboxylate; vanadium(4+)
IUPAC Name: naphthalene-2-carboxylate; vanadium(4+)
SYSTEMATIC NAME: naphthalene-2-carboxylate; vanadium(4+)
MOLECULAR FORMULA: C44H28O8V
MOLECULAR WEIGHT: 735.62982
SMILES: C1=CC=C2C=C(C=CC2=C1)C(=O)[O-].C1=CC=C2C=C(C=CC2=C1)C(=O)[O-].C1=CC=C2C=C(C=CC2=C1)C(=O)[O-].C1=CC=C2C=C(C=CC2=C1)C(=O)[O-].[V+4]
Structure:
CAS RN: 139889-57-9
CAS Name: sodium (2S)-2-ethylhexanoate
OPENEYE Name: sodium (2S)-2-ethylhexanoate
IUPAC Name: sodium (2S)-2-ethylhexanoate
SYSTEMATIC NAME: sodium (2S)-2-ethylhexanoate
MOLECULAR FORMULA: C8H15NaO2
MOLECULAR WEIGHT: 166.19327
SMILES: CCCC[C@H](CC)C(=O)[O-].[Na+]
Structure:
CAS RN: 19142-74-6
CAS Name: dipotassium 8-oxo-7,9-dihydropurine-2,6-diolate hydrate
OPENEYE Name: dipotassium 8-oxo-7,9-dihydropurine-2,6-diolate hydrate
IUPAC Name: dipotassium 8-oxo-7,9-dihydropurine-2,6-diolate hydrate
SYSTEMATIC NAME: dipotassium 8-oxidanylidene-7,9-dihydropurine-2,6-diolate hydrate
MOLECULAR FORMULA: C5H4K2N4O4
MOLECULAR WEIGHT: 262.30626
SMILES: C12=C(NC(=O)N1)N=C(N=C2[O-])[O-].O.[K+].[K+]
Structure:
CAS RN: 12125-06-3
CAS Name: ammonium magnesium trichloride hexahydrate
OPENEYE Name: ammonium magnesium trichloride hexahydrate
IUPAC Name: azanium magnesium trichloride hexahydrate
SYSTEMATIC NAME: azanium magnesium trichloride hexahydrate
MOLECULAR FORMULA: Cl3H16MgNO6
MOLECULAR WEIGHT: 256.79414
SMILES: [NH4+].O.O.O.O.O.O.[Mg+2].[Cl-].[Cl-].[Cl-]
Structure:
CAS RN: 15230-79-2
CAS Name: lutetium(3+) trichloride hexahydrate
OPENEYE Name: lutetium(3+) trichloride hexahydrate
IUPAC Name: lutetium(3+) trichloride hexahydrate
SYSTEMATIC NAME: lutetium(3+) trichloride hexahydrate
MOLECULAR FORMULA: Cl3H12LuO6
MOLECULAR WEIGHT: 389.41768
SMILES: O.O.O.O.O.O.[Cl-].[Cl-].[Cl-].[Lu+3]
Structure:
CAS RN: 13601-18-8
CAS Name: tetralithium iron(2+) hexacyanide
OPENEYE Name: ferrous tetralithium hexacyanide
IUPAC Name: tetralithium iron(2+) hexacyanide
SYSTEMATIC NAME: tetralithium iron(2+) hexacyanide
MOLECULAR FORMULA: C6FeLi4N6
MOLECULAR WEIGHT: 239.7134
SMILES: [Li+].[Li+].[Li+].[Li+].[C-]#N.[C-]#N.[C-]#N.[C-]#N.[C-]#N.[C-]#N.[Fe+2]
Structure:
CAS RN: 25659-31-8
CAS Name: lead(2+) diiodate
OPENEYE Name: plumbous diiodate
IUPAC Name: lead(2+) diiodate
SYSTEMATIC NAME: lead(2+) diiodate
MOLECULAR FORMULA: I2O6Pb
MOLECULAR WEIGHT: 557.00534
SMILES: [O-]I(=O)=O.[O-]I(=O)=O.[Pb+2]
Structure:
CAS RN: 25234-60-0
CAS Name: trimethyl-[2-(1-oxododecoxy)ethyl]ammonium bromide
OPENEYE Name: 2-dodecanoyloxyethyl(trimethyl)ammonium bromide
IUPAC Name: 2-dodecanoyloxyethyl(trimethyl)azanium bromide
SYSTEMATIC NAME: 2-dodecanoyloxyethyl(trimethyl)azanium bromide
MOLECULAR FORMULA: C17H36BrNO2
MOLECULAR WEIGHT: 366.37724
SMILES: CCCCCCCCCCCC(=O)OCC[N+](C)(C)C.[Br-]
Structure:
CAS RN: 312619-49-1
CAS Name: holmium(3+) triacetate hydrate
OPENEYE Name: holmium(3+) triacetate hydrate
IUPAC Name: holmium(3+) triacetate hydrate
SYSTEMATIC NAME: holmium(3+) triethanoate hydrate
MOLECULAR FORMULA: C6H11HoO7
MOLECULAR WEIGHT: 360.07766
SMILES: CC(=O)[O-].CC(=O)[O-].CC(=O)[O-].O.[Ho+3]
Structure:
CAS RN: 60-25-3
CAS Name: trimethyl-[6-(trimethylammonio)hexyl]ammonium dichloride hydrate
OPENEYE Name: trimethyl-[6-(trimethylammonio)hexyl]ammonium dichloride hydrate
IUPAC Name: trimethyl-[6-(trimethylazaniumyl)hexyl]azanium dichloride hydrate
SYSTEMATIC NAME: trimethyl-[6-(trimethylazaniumyl)hexyl]azanium dichloride hydrate
MOLECULAR FORMULA: C12H32Cl2N2O
MOLECULAR WEIGHT: 291.30128
SMILES: C[N+](C)(C)CCCCCC[N+](C)(C)C.O.[Cl-].[Cl-]
Structure:
CAS RN: 15280-55-4
CAS Name: dysprosium(3+) triacetate tetrahydrate
OPENEYE Name: dysprosium(3+) triacetate tetrahydrate
IUPAC Name: dysprosium(3+) triacetate tetrahydrate
SYSTEMATIC NAME: dysprosium(3+) triethanoate tetrahydrate
MOLECULAR FORMULA: C6H17DyO10
MOLECULAR WEIGHT: 411.69318
SMILES: CC(=O)[O-].CC(=O)[O-].CC(=O)[O-].O.O.O.O.[Dy+3]
Structure:
CAS RN: 33678-73-8
CAS Name: N-(4-diazo-6-methyl-1-cyclohexa-1,5-dienyl)-N-ethylhydroxylamine
OPENEYE Name: N-(4-diazo-6-methyl-cyclohexa-1,5-dien-1-yl)-N-ethyl-hydroxylamine
IUPAC Name: N-(4-diazo-6-methylcyclohexa-1,5-dien-1-yl)-N-ethylhydroxylamine
SYSTEMATIC NAME: N-(4-diazo-6-methyl-cyclohexa-1,5-dien-1-yl)-N-ethyl-hydroxylamine
MOLECULAR FORMULA: C9H13N3O
MOLECULAR WEIGHT: 179.21902
SMILES: CCN(C1=CCC(=[N+]=[N-])C=C1C)O
Structure:
CAS RN: 1273-94-5
CAS Name: 1-(1-cyclopenta-2,4-dienylidene)ethanolate; iron
OPENEYE Name: 1-cyclopenta-2,4-dien-1-ylideneethanolate; iron
IUPAC Name: 1-cyclopenta-2,4-dien-1-ylideneethanolate; iron
SYSTEMATIC NAME: 1-cyclopenta-2,4-dien-1-ylideneethanolate; iron
MOLECULAR FORMULA: C14H14FeO2-2
MOLECULAR WEIGHT: 270.10476
SMILES: CC(=C1C=CC=C1)[O-].CC(=C1C=CC=C1)[O-].[Fe]
Structure:
CAS RN: 15168-20-4
CAS Name: copper selenite dihydrate
OPENEYE Name: copper selenite dihydrate
IUPAC Name: copper selenite dihydrate
SYSTEMATIC NAME: copper selenite dihydrate
MOLECULAR FORMULA: CuH4O5Se
MOLECULAR WEIGHT: 226.53476
SMILES: O.O.[O-][Se](=O)[O-].[Cu+2]
Structure:
CAS RN: 10031-45-5
CAS Name: copper selenate pentahydrate
OPENEYE Name: copper selenate pentahydrate
IUPAC Name: copper selenate pentahydrate
SYSTEMATIC NAME: copper selenate pentahydrate
MOLECULAR FORMULA: CuH10O9Se
MOLECULAR WEIGHT: 296.58
SMILES: O.O.O.O.O.[O-][Se](=O)(=O)[O-].[Cu+2]
Structure:
CAS RN: 13454-88-1
CAS Name: copper difluoride dihydrate
OPENEYE Name: copper difluoride dihydrate
IUPAC Name: copper difluoride dihydrate
SYSTEMATIC NAME: copper difluoride dihydrate
MOLECULAR FORMULA: CuF2H4O2
MOLECULAR WEIGHT: 137.573366
SMILES: O.O.[F-].[F-].[Cu+2]
Structure:
CAS RN: 13817-37-3
CAS Name: cobalt(2+) difluoride tetrahydrate
OPENEYE Name: cobaltous difluoride tetrahydrate
IUPAC Name: cobalt(2+) difluoride tetrahydrate
SYSTEMATIC NAME: cobalt(2+) difluoride tetrahydrate
MOLECULAR FORMULA: CoF2H8O4
MOLECULAR WEIGHT: 168.991126
SMILES: O.O.O.O.[F-].[F-].[Co+2]
Structure:
CAS RN: 68886-78-2
CAS Name: chromium(3+) trifluoride hydrate
OPENEYE Name: chromic trifluoride hydrate
IUPAC Name: chromium(3+) trifluoride hydrate
SYSTEMATIC NAME: chromium(3+) trifluoride hydrate
MOLECULAR FORMULA: CrF3H2O
MOLECULAR WEIGHT: 127.00659
SMILES: O.[F-].[F-].[F-].[Cr+3]
Structure:
CAS RN: 824-35-1
CAS Name: calcium 2-hydroxybenzoate dihydrate
OPENEYE Name: calcium 2-hydroxybenzoate dihydrate
IUPAC Name: calcium 2-hydroxybenzoate dihydrate
SYSTEMATIC NAME: calcium 2-oxidanylbenzoate dihydrate
MOLECULAR FORMULA: C14H14CaO8
MOLECULAR WEIGHT: 350.33416
SMILES: C1=CC=C(C(=C1)C(=O)[O-])O.C1=CC=C(C(=C1)C(=O)[O-])O.O.O.[Ca+2]
Structure:
CAS RN: 19455-76-6
CAS Name: calcium propanedioate hydrate
OPENEYE Name: calcium propanedioate hydrate
IUPAC Name: calcium propanedioate hydrate
SYSTEMATIC NAME: calcium propanedioate hydrate
MOLECULAR FORMULA: C3H4CaO5
MOLECULAR WEIGHT: 160.13886
SMILES: C(C(=O)[O-])C(=O)[O-].O.[Ca+2]
Structure:
CAS RN: 17139-96-7
CAS Name: calcium (2-hydroxyphenoxy)methanesulfonate
OPENEYE Name: calcium (2-hydroxyphenoxy)methanesulfonate
IUPAC Name: calcium (2-hydroxyphenoxy)methanesulfonate
SYSTEMATIC NAME: calcium (2-oxidanylphenoxy)methanesulfonate
MOLECULAR FORMULA: C14H14CaO10S2
MOLECULAR WEIGHT: 446.46296
SMILES: C1=CC=C(C(=C1)O)OCS(=O)(=O)[O-].C1=CC=C(C(=C1)O)OCS(=O)(=O)[O-].[Ca+2]
Structure:
CAS RN: 1304-82-1
CAS Name: bismuth; tellurium
OPENEYE Name: bismuth; tellurium
IUPAC Name: bismuth; tellurium
SYSTEMATIC NAME: bismuth; tellurium
MOLECULAR FORMULA: Bi4Te6
MOLECULAR WEIGHT: 1601.52152
SMILES: [Te].[Te].[Te].[Te].[Te].[Te].[Bi].[Bi].[Bi].[Bi]
Structure:
CAS RN: 590-47-6
CAS Name: 2-(trimethylammonio)acetate hydrate
OPENEYE Name: 2-(trimethylammonio)acetate hydrate
IUPAC Name: 2-(trimethylazaniumyl)acetate hydrate
SYSTEMATIC NAME: 2-(trimethylazaniumyl)ethanoate hydrate
MOLECULAR FORMULA: C5H13NO3
MOLECULAR WEIGHT: 135.16162
SMILES: C[N+](C)(C)CC(=O)[O-].O
Structure:
No comments:
Post a Comment