Hecogenin Acetate

[(1R,2S,4S,5'R,6R,7S,8R,9S,12S,13S,16S,18S)-5',7,9,13-tetramethyl-10-oxospiro[5-oxapentacyclo[10.8.0.02,9.04,8.013,18]icosane-6,2'-oxane]-16-yl] acetate

Also Known As: Hecogenin acetate|HECOGENINACETATE|Hecogenin Acetate, 90%|(-)-Hecogenin acetate|HECOGENIN, ACETATE|Hecogenin acetate, >=90%|3beta-Acetoxy-5alpha-spirostan-12-one|EINECS 213-021-7|ERK5-7E15|12-Oxo-5-alpha-spirostan-3-beta-yl acetate|AI3-44894|Spirostan-12-one, 3-(acetyloxy)-, (3b,5a,25R)-|(3beta,5alpha,25R)-12-oxospirostan-3-yl acetate|3beta-acetoxy-(25r)-5alpha-spirostan-12-one|(25R)-3beta-Acetoxy-5alpha-spirostane-12-one|(25R)-3beta-Acetyloxy-5alpha-spirostan-12-one|5.alpha.-Spirostan-12-one, acetate, (25R)-|Spirostan-12-one, (3.beta.,5.alpha.,25R)-|5alpha,25D-Spirostan-12-one, 3beta-hydroxy-, acetate|[(1R,2S,4S,5'R,6R,7S,8R,9S,12S,13S,16S,18S)-5',7,9,13-tetramethyl-10-oxospiro[5-oxapentacyclo[10.8.0.02,9.04,8.013,18]icosane-6,2'-oxane]-16-yl] acetate|3.BETA.-ACETOXY-5.ALPHA.-SPIROSTAN-12-ONE|Spirostan-12-one, 3-(acetyloxy)-, (3beta,5alpha,25R)-|Spirostan-12-one,3-(acetyloxy)-,(3b,5a,25R)-|(25R)-3beta-Hydroxy-5alpha-spirostane-12-one=acetate|5.alpha.-Spirostan-12-one, 3.beta.-hydroxy-, acetate, (25R)-

Molecular Formula	C29H44O5
Molecular Weight	472.31888 g/mol
LogP	5.54
Topological Polar Surface Area	61.83 Ų
Hydrogen Bond Donors	0
Hydrogen Bond Acceptors	5
Rotatable Bonds	1
Exact Mass	472.31888
Heavy Atoms	34
Complexity	860.6

Chemical Identifiers

CAS Number	915-35-5
SMILES	C[C@@H]1CC[C@@]2([C@H]([C@H]3[C@@H](O2)C[C@@H]4[C@@]3(C(=O)C[C@H]5[C@H]4CC[C@@H]6[C@@]5(CC[C@@H](C6)OC(=O)C)C)C)C)OC1