 Home > Encyclopedia > (3R,5R,8R,9S,10S,13S,14S,17R)-17-[(1S)-1,2-dihydroxyethyl]-10,13-dimethyl-1,2,3,4,5,6,7,8,9,11,12,14,15,16-tetradecahydrocyclopenta[a]phenanthrene-3,17-diol

(3R,5R,8R,9S,10S,13S,14S,17R)-17-[(1S)-1,2-dihydroxyethyl]-10,13-dimethyl-1,2,3,4,5,6,7,8,9,11,12,14,15,16-tetradecahydrocyclopenta[a]phenanthrene-3,17-diol

(3R,5R,8R,9S,10S,13S,14S,17R)-17-[(1S)-1,2-dihydroxyethyl]-10,13-dimethyl-1,2,3,4,5,6,7,8,9,11,12,14,15,16-tetradecahydrocyclopenta[a]phenanthrene-3,17-diol structure

CAS No:
3615-89-2
Formula:
C21H36O4
Chemical Name:
(3R,5R,8R,9S,10S,13S,14S,17R)-17-[(1S)-1,2-dihydroxyethyl]-10,13-dimethyl-1,2,3,4,5,6,7,8,9,11,12,14,15,16-tetradecahydrocyclopenta[a]phenanthrene-3,17-diol
Synonyms:
20 alpha-hexahydro-Reichstein's compound S;5 beta-pregnane-3 alpha,17 alpha,20 beta,21-tetrol;5 beta-pregnane-3alpha,17alpha,20alpha,21-tetrol;5 beta-pregnane-3alpha,17alpha,20alpha,21-tetrol, (3beta,5beta,17alpha,20R)-isomer;3615-89-2;Pregnane-3,17,20,21-tetrol;20alpha-Hexahydro-reichstein's compound S;5beta-Pregnane-3alpha,17alpha,20beta,21-tetrol;5beta-Pregnane-3alpha,17alpha,20alpha,21-tetrol;SCHEMBL16226949;DTXSID00957565;(3R,5R,8R,9S,10S,13S,14S,17R)-17-[(1S)-1,2-dihydroxyethyl]-10,13-dimethyl-1,2,3,4,5,6,7,8,9,11,12,14,15,16-tetradecahydrocyclopenta[a]phenanthrene-3,17-diol;(3alpha,5beta,20S)-Pregnane-3,17,20,21-tetrol;Pregnane-3,17,20,21-tetrol, (3alpha,5beta,20S)-

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(3R,5R,8R,9S,10S,13S,14S,17R)-17-[(1S)-1,2-dihydroxyethyl]-10,13-dimethyl-1,2,3,4,5,6,7,8,9,11,12,14,15,16-tetradecahydrocyclopenta[a]phenanthrene-3,17-diol Basic Attributes

Molecular Weight：

352.5 g/mol

Exact Mass：

352.26135963 g/mol

Characteristics

PSA：

80.9 Å²

Drug Information

MeSH Entry Terms：

20 alpha-hexahydro-Reichstein's compound S

Computed Properties

Molecular Weight:352.5
XLogP3:3.3
Hydrogen Bond Donor Count:4
Hydrogen Bond Acceptor Count:4
Rotatable Bond Count:2
Exact Mass:352.26135963
Monoisotopic Mass:352.26135963
Topological Polar Surface Area:80.9
Heavy Atom Count:25
Complexity:524
Defined Atom Stereocenter Count:9
Covalently-Bonded Unit Count:1
Compound Is Canonicalized:Yes

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Guide of (3R,5R,8R,9S,10S,13S,14S,17R)-17-[(1S)-1,2-dihydroxyethyl]-10,13-dimethyl-1,2,3,4,5,6,7,8,9,11,12,14,15,16-tetradecahydrocyclopenta[a]phenanthrene-3,17-diol

Basic Attributes
Characteristics
Drug Information
Computed Properties

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