CAS RN: 59086-92-9
CAS Name:
OPENEYE Name:
IUPAC Name:
SYSTEMATIC NAME:
MOLECULAR FORMULA: C35H52O8
MOLECULAR WEIGHT: 600.78258
SMILES: CCCCCCCCCC(=O)O[C@@]12[C@@H](C1(C)C)[C@@H]3C=C(C[C@]4([C@H]([C@]3([C@@H]([C@H]2OC(=O)/C(=C\C)/C)C)O)C=C(C4=O)C)O)CO
Structure:
CAS RN: 1732-37-2
CAS Name:
OPENEYE Name:
IUPAC Name:
SYSTEMATIC NAME:
MOLECULAR FORMULA: C29H22O11
MOLECULAR WEIGHT: 546.47838
SMILES: CC1=CC(=C2C3=C1C(=O)C4[C@@H]([C@@]3(COC2=O)[C@@H]5[C@]4(C6=C7C(=COC(=O)C7=C(C=C6C)O)C5=O)OC)OC(=O)C)O
Structure:
CAS RN: 20284-40-6
CAS Name: 2-[(E)-3-(1H-imidazol-5-yl)-1-oxoprop-2-enoxy]ethyl-trimethylammonium
OPENEYE Name: 2-[(E)-3-(1H-imidazol-5-yl)prop-2-enoyl]oxyethyl-trimethyl-ammonium
IUPAC Name: 2-[(E)-3-(1H-imidazol-5-yl)prop-2-enoyl]oxyethyl-trimethylazanium
SYSTEMATIC NAME: 2-[(E)-3-(1H-imidazol-5-yl)prop-2-enoyl]oxyethyl-trimethyl-azanium
MOLECULAR FORMULA: C11H18N3O2+
MOLECULAR WEIGHT: 224.27952
SMILES: C[N+](C)(C)CCOC(=O)/C=C/C1=CN=CN1
Structure:
CAS RN: 53472-38-1
CAS Name: (3S,5E,8E)-8-(1-bromopropylidene)-3-chloro-2-[(Z)-pent-2-en-4-ynyl]-2,3,4,7-tetrahydrooxocin
OPENEYE Name: (3S,5E,8E)-8-(1-bromopropylidene)-3-chloro-2-[(Z)-pent-2-en-4-ynyl]-2,3,4,7-tetrahydrooxocine
IUPAC Name: (3S,5E,8E)-8-(1-bromopropylidene)-3-chloro-2-[(Z)-pent-2-en-4-ynyl]-2,3,4,7-tetrahydrooxocine
SYSTEMATIC NAME: (3S,5E,8E)-8-(1-bromanylpropylidene)-3-chloranyl-2-[(Z)-pent-2-en-4-ynyl]-2,3,4,7-tetrahydrooxocine
MOLECULAR FORMULA: C15H18BrClO
MOLECULAR WEIGHT: 329.65982
SMILES: CC/C(=C\1/C/C=C/C[C@@H](C(O1)C/C=C\C#C)Cl)/Br
Structure:
CAS RN: 167324-05-2
CAS Name: 3-[[4,5-dihydroxy-6-(hydroxymethyl)-3-[[3,4,5-trihydroxy-6-(hydroxymethyl)-2-oxanyl]oxy]-2-oxanyl]oxy]-2-hydroxy-6b-(hydroxymethyl)-4,6a,11,11,14b-pentamethyl-1,2,3,4a,5,6,7,8,9,10,12,12a,14,14a-tetradecahydropicene-4,8a-dicarboxylic acid
OPENEYE Name: 3-[4,5-dihydroxy-6-(hydroxymethyl)-3-[3,4,5-trihydroxy-6-(hydroxymethyl)tetrahydropyran-2-yl]oxy-tetrahydropyran-2-yl]oxy-2-hydroxy-6b-(hydroxymethyl)-4,6a,11,11,14b-pentamethyl-1,2,3,4a,5,6,7,8,9,10,12,12a,14,14a-tetradecahydropicene-4,8a-dicarboxylic ac
IUPAC Name: 3-[4,5-dihydroxy-6-(hydroxymethyl)-3-[3,4,5-trihydroxy-6-(hydroxymethyl)oxan-2-yl]oxyoxan-2-yl]oxy-2-hydroxy-6b-(hydroxymethyl)-4,6a,11,11,14b-pentamethyl-1,2,3,4a,5,6,7,8,9,10,12,12a,14,14a-tetradecahydropicene-4,8a-dicarboxylic acid
SYSTEMATIC NAME: 6b-(hydroxymethyl)-3-[6-(hydroxymethyl)-3-[6-(hydroxymethyl)-3,4,5-tris(oxidanyl)oxan-2-yl]oxy-4,5-bis(oxidanyl)oxan-2-yl]oxy-4,6a,11,11,14b-pentamethyl-2-oxidanyl-1,2,3,4a,5,6,7,8,9,10,12,12a,14,14a-tetradecahydropicene-4,8a-dicarboxylic acid
MOLECULAR FORMULA: C42H66O17
MOLECULAR WEIGHT: 842.96324
SMILES: CC1(CCC2(CCC3(C(=CCC4C3(CCC5C4(CC(C(C5(C)C(=O)O)OC6C(C(C(C(O6)CO)O)O)OC7C(C(C(C(O7)CO)O)O)O)O)C)C)C2C1)CO)C(=O)O)C
Structure:
CAS RN: 57800-56-3
CAS Name:
OPENEYE Name:
IUPAC Name:
SYSTEMATIC NAME:
MOLECULAR FORMULA: C24H32O10
MOLECULAR WEIGHT: 480.50488
SMILES: C/C=C(/COC(=O)C)\C(=O)O[C@@H]1C[C@]2(CC[C@H]([C@H](C(O2)[C@@H]3[C@@H]1C(=C)C(=O)O3)COC(=O)C)O)C
Structure:
CAS RN: 19763-41-8
CAS Name: (2S,3S)-2-hydroxytridecane-1,2,3-tricarboxylic acid
OPENEYE Name: (2S,3S)-2-hydroxytridecane-1,2,3-tricarboxylic acid
IUPAC Name: (2S,3S)-2-hydroxytridecane-1,2,3-tricarboxylic acid
SYSTEMATIC NAME: (2S,3S)-2-oxidanyltridecane-1,2,3-tricarboxylic acid
MOLECULAR FORMULA: C16H28O7
MOLECULAR WEIGHT: 332.38932
SMILES: CCCCCCCCCC[C@H](C(=O)O)[C@@](CC(=O)O)(C(=O)O)O
Structure:
CAS RN: 508-65-6
CAS Name:
OPENEYE Name:
IUPAC Name:
SYSTEMATIC NAME:
MOLECULAR FORMULA: C27H43NO8
MOLECULAR WEIGHT: 509.63222
SMILES: C[C@H]1CC[C@H]2[C@@]([C@@H]3[C@@H](CN2C1)[C@@H]4C[C@@]56[C@H]([C@@]4([C@H]([C@@H]3O)O)O)[C@@H](C[C@H]7[C@@]5(CC[C@@H](C7(O6)O)O)C)O)(C)O
Structure:
CAS RN: 53683-73-1
CAS Name:
OPENEYE Name:
IUPAC Name:
SYSTEMATIC NAME:
MOLECULAR FORMULA: C25H34O9
MOLECULAR WEIGHT: 478.53206
SMILES: CCC(C)C(=O)O[C@@H]1[C@H]2[C@H]([C@H](C3([C@H]4[C@@]2(CO3)[C@@H](C[C@@H]5[C@@]4([C@@H](C(=O)C=C5C)O)C)OC1=O)O)O)C
Structure:
CAS RN: 1402-50-2
CAS Name: 2-amino-4,6-dimethyl-3-oxo-N1-[4,7,10,16-tetramethyl-2,5,8,11,14-pentaoxo-3,12-di(propan-2-yl)-1-oxa-4,7,10,13-tetrazacyclohexadec-15-yl]-N9-[7,11,14-trimethyl-2,5,9,12,15-pentaoxo-3,10-di(propan-2-yl)-8-oxa-1,4,11,14-tetrazabicyclo[14.3.0]nonadecan-6-yl]
OPENEYE Name: 2-amino-N1-(3,12-diisopropyl-4,7,10,16-tetramethyl-2,5,8,11,14-pentaoxo-1-oxa-4,7,10,13-tetrazacyclohexadec-15-yl)-N9-(3,10-diisopropyl-7,11,14-trimethyl-2,5,9,12,15-pentaoxo-8-oxa-1,4,11,14-tetrazabicyclo[14.3.0]nonadecan-6-yl)-4,6-dimethyl-3-oxo-phenoxa
IUPAC Name: 2-amino-4,6-dimethyl-3-oxo-1-N-[4,7,10,16-tetramethyl-2,5,8,11,14-pentaoxo-3,12-di(propan-2-yl)-1-oxa-4,7,10,13-tetrazacyclohexadec-15-yl]-9-N-[7,11,14-trimethyl-2,5,9,12,15-pentaoxo-3,10-di(propan-2-yl)-8-oxa-1,4,11,14-tetrazabicyclo[14.3.0]nonadecan-6-y
SYSTEMATIC NAME: 2-azanyl-4,6-dimethyl-3-oxidanylidene-N1-[4,7,10,16-tetramethyl-2,5,8,11,14-pentakis(oxidanylidene)-3,12-di(propan-2-yl)-1-oxa-4,7,10,13-tetrazacyclohexadec-15-yl]-N9-[7,11,14-trimethyl-2,5,9,12,15-pentakis(oxidanylidene)-3,10-di(propan-2-yl)-8-oxa-1,4,11
MOLECULAR FORMULA: C60H84N12O16
MOLECULAR WEIGHT: 1229.37976
SMILES: CC1C(C(=O)NC(C(=O)N2CCCC2C(=O)N(CC(=O)N(C(C(=O)O1)C(C)C)C)C)C(C)C)NC(=O)C3=C4C(=C(C=C3)C)OC5=C(C(=O)C(=C(C5=N4)C(=O)NC6C(OC(=O)C(N(C(=O)CN(C(=O)CN(C(=O)C(NC6=O)C(C)C)C)C)C)C(C)C)C)N)C
Structure:
CAS RN: 1263-89-4
CAS Name: 5-amino-2-(aminomethyl)-6-[[5-[3,5-diamino-2-[[3-amino-4,5-dihydroxy-6-(hydroxymethyl)-2-oxanyl]oxy]-6-hydroxycyclohexyl]oxy-4-hydroxy-2-(hydroxymethyl)-3-oxolanyl]oxy]oxane-3,4-diol; sulfuric acid
OPENEYE Name: 5-amino-2-(aminomethyl)-6-[5-[3,5-diamino-2-[3-amino-4,5-dihydroxy-6-(hydroxymethyl)tetrahydropyran-2-yl]oxy-6-hydroxy-cyclohexoxy]-4-hydroxy-2-(hydroxymethyl)tetrahydrofuran-3-yl]oxy-tetrahydropyran-3,4-diol; sulfuric acid
IUPAC Name: 5-amino-2-(aminomethyl)-6-[5-[3,5-diamino-2-[3-amino-4,5-dihydroxy-6-(hydroxymethyl)oxan-2-yl]oxy-6-hydroxycyclohexyl]oxy-4-hydroxy-2-(hydroxymethyl)oxolan-3-yl]oxyoxane-3,4-diol; sulfuric acid
SYSTEMATIC NAME: 2-(aminomethyl)-5-azanyl-6-[5-[3,5-bis(azanyl)-2-[3-azanyl-6-(hydroxymethyl)-4,5-bis(oxidanyl)oxan-2-yl]oxy-6-oxidanyl-cyclohexyl]oxy-2-(hydroxymethyl)-4-oxidanyl-oxolan-3-yl]oxy-oxane-3,4-diol; sulfuric acid
MOLECULAR FORMULA: C23H47N5O18S
MOLECULAR WEIGHT: 713.70698
SMILES: C1C(C(C(C(C1N)OC2C(C(C(C(O2)CO)O)O)N)OC3C(C(C(O3)CO)OC4C(C(C(C(O4)CN)O)O)N)O)O)N.OS(=O)(=O)O
Structure:
CAS RN: 24338-53-2
CAS Name:
OPENEYE Name:
IUPAC Name:
SYSTEMATIC NAME:
MOLECULAR FORMULA: C19H22O7
MOLECULAR WEIGHT: 362.37378
SMILES: CC(C)C1=C2[C@H]([C@@H]3C4[C@]([C@H]([C@@H]5[C@H]([C@@]4(C2=CC(=O)O1)C)O5)O)(C(=O)O3)C)O
Structure:
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