Fasciculol G

[(2R,3R,10S,12S,13R,14S,17R)-17-[(2R)-5,6-dihydroxy-6-methylheptan-2-yl]-2,12-dihydroxy-4,4,10,13,14-pentamethyl-2,3,5,6,7,11,12,15,16,17-decahydro-1H-cyclopenta[a]phenanthren-3-yl] 3-hydroxy-5-[(2-methoxy-2-oxoethyl)amino]-3-methyl-5-oxopentanoate

Also Known As: Fasciculol G|KST-1A8793|(2|A,3|A,5xi,12|A)-2,12,24,25-tetrahydroxylanost-8-en-3-yl 3-hydroxy-5-[(2-methoxy-2-oxoethyl)amino]-3-methyl-5-oxopentanoate|[(2R,3R,10S,12S,13R,14S,17R)-17-[(2R)-5,6-dihydroxy-6-methylheptan-2-yl]-2,12-dihydroxy-4,4,10,13,14-pentamethyl-2,3,5,6,7,11,12,15,16,17-decahydro-1H-cyclopenta[a]phenanthren-3-yl] 3-hydroxy-5-[(2-methoxy-2-oxoethyl)amino]-3-methyl-5-oxopentanoate|(24r)-5alpha-lanost-8-ene-2alpha,3beta,12alpha,24,25-pentol 3-[3-hydroxy-5-[(2-methoxy-2-oxoethyl)amino]-3-methyl-5-oxopentanoate]|3-Hydroxy-N-(2-methoxy-2-oxoethyl)-3-methyl-5-oxo-5-[(2,12,24,25-tetrahydroxylanost-8-en-3-yl)oxy]pentanimidic acid|3-Hydroxy-N-(2-methoxy-2-oxoethyl)-3-methyl-5-oxo-5-{[(5xi)-2alpha,12alpha,24,25-tetrahydroxylanost-8-en-3beta-yl]oxy}pentanimidic acid

Molecular Formula	C39H65NO10
Molecular Weight	707.4609 g/mol
LogP	3.6
Topological Polar Surface Area	183.0 Ų
Hydrogen Bond Donors	6
Hydrogen Bond Acceptors	10
Rotatable Bonds	14
Exact Mass	707.4609
Monoisotopic Mass	707.4609
Heavy Atoms	50
Complexity	1340.0

Chemical Identifiers

CAS Number	69770-64-5
SMILES	C[C@H](CCC(C(C)(C)O)O)[C@H]1CC[C@@]2([C@@]1([C@H](CC3=C2CCC4[C@@]3(C[C@H]([C@@H](C4(C)C)OC(=O)CC(C)(CC(=O)NCC(=O)OC)O)O)C)O)C)C
InChIKey	GVPJLBFYVFKWHU-WHBFOGTJSA-N