(3beta,4alpha,15alpha,16beta)-4,9-Epoxycevane-3,4,14,15,16,20-hexol

(1S,2S,6S,9S,10S,11R,12R,13S,14S,15S,18S,19S,22S,23S,25R)-6,10,19-trimethyl-24-oxa-4-azaheptacyclo[12.12.0.02,11.04,9.015,25.018,23.019,25]hexacosane-10,12,13,14,22,23-hexol

Also Known As: Zygadenine|Zygadenin|ZYGADENINE [MI]|4,9-Epoxycevane-3,4,14,15,16,20-hexol|(1S,2S,6S,9S,10S,11R,12R,13S,14S,15S,18S,19S,22S,23S,25R)-6,10,19-trimethyl-24-oxa-4-azaheptacyclo[12.12.0.02,11.04,9.015,25.018,23.019,25]hexacosane-10,12,13,14,22,23-hexol|Cevane-3,4,14,15,16,20-hexol, 4,9-epoxy-, (3beta,4alpha,15alpha,16beta)-|4,9-Epoxycevane-3beta,4alpha,14,15alpha,16beta,20-hexol|4alpha,9-Epoxycevane-3beta,4,14,15alpha,16beta,20-hexol|4|A,9-epoxy-5|A-cevane-3|A,4|A,14,15|A,16|A-20-hexaol|(3beta,4alpha,15alpha,16beta)-4,9-Epoxycevane-3,4,14,15,16,20-hexol|(1S,2S,6S,9S,10S,11R,12R,13S,14S,15S,18S,19S,22S,23S,25R)-6,10,19-trimethyl-24-oxa-4-azaheptacyclo(12.12.0.02,11.04,9.015,25.018,23.019,25)hexacosane-10,12,13,14,22,23-hexol|(2R,3S,5R)-2-((1S)-1-((3S,5S,8R,9S,10S,13S,14S,16R,17R)-3-amino-16-hydroxy-10,13-dimethyl-2,3,4,5,6,7,8,9,11,12,14,15,16,17-tetradecahydro-1H-cyclopenta(a)phenanthren-17-yl)ethyl)-5-methyl-piperidin-3-ol|CEVANE-3,4,14,15,16,20-HEXOL, 4,9-EPOXY-, (3.BETA.,4.ALPHA.,15.ALPHA.,16.BETA.)-

Molecular Formula	C27H43NO7
Molecular Weight	493.30396 g/mol
LogP	-0.1
Topological Polar Surface Area	134.0 Ų
Hydrogen Bond Donors	6
Hydrogen Bond Acceptors	8
Rotatable Bonds	0
Exact Mass	493.30396
Monoisotopic Mass	493.30396
Heavy Atoms	35
Complexity	935.0

Chemical Identifiers

CAS Number	545-45-9
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)CC[C@H]7[C@@]5(CC[C@@H]([C@]7(O6)O)O)C)(C)O
InChIKey	NPNDUIMQBJIGQS-IDFKWMMPSA-N