16.ALPHA.-HYDROXYETIOCHOLANOLONE

Details

Stereochemistry	ABSOLUTE
Molecular Formula	C19H30O3
Molecular Weight	306.4397
Optical Activity	UNSPECIFIED
Defined Stereocenters	8 / 8
E/Z Centers	0
Charge	0

SHOW SMILES / InChI

Structure of 16.ALPHA.-HYDROXYETIOCHOLANOLONE

Structure Search

SMILES

C[C@]12CC[C@H]3[C@@H](CC[C@@H]4C[C@H](O)CC[C@]34C)[C@@H]1C[C@@H](O)C2=O

InChI

InChIKey=HLQYTKUIIJTNHH-NMTBMHBSSA-N

InChI=1S/C19H30O3/c1-18-7-5-12(20)9-11(18)3-4-13-14(18)6-8-19(2)15(13)10-16(21)17(19)22/h11-16,20-21H,3-10H2,1-2H3/t11-,12-,13-,14+,15+,16-,18+,19+/m1/s1

HIDE SMILES / InChI

Approval Year

Name

Type

Language

16.ALPHA.-HYDROXYETIOCHOLANOLONE

Common Name

English

3.ALPHA.,16.ALPHA.-DIHYDROXY-5.BETA.-ANDROSTAN-17-ONE

Preferred Name

English

(3S,5S,8R,9S,10R,13R,14S,16R)-10,13-DIMETHYL-3,16-BIS(OXIDANYL)-1,2,3,4,5,6,7,8,9,11,12,14,15,16-TETRADECAHYDROCYCLOPENTA(A)PHENANTHREN-17-ONE

Systematic Name

English

ANDROSTAN-17-ONE, 3,16-DIHYDROXY-, (3.ALPHA.,5.BETA.,16.ALPHA.)-

Common Name

English

Code System Code Type Description

CAS

14167-49-8

Created by admin on Wed Apr 02 05:49:21 GMT 2025 , Edited by admin on Wed Apr 02 05:49:21 GMT 2025

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FDA UNII

B81719Q742

Created by admin on Wed Apr 02 05:49:21 GMT 2025 , Edited by admin on Wed Apr 02 05:49:21 GMT 2025

PRIMARY

EPA CompTox

DTXSID10463147

Created by admin on Wed Apr 02 05:49:21 GMT 2025 , Edited by admin on Wed Apr 02 05:49:21 GMT 2025

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PUBCHEM

11243707

Created by admin on Wed Apr 02 05:49:21 GMT 2025 , Edited by admin on Wed Apr 02 05:49:21 GMT 2025

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SUBSTANCE RECORD


					B81719Q742

16.ALPHA.-HYDROXYETIOCHOLANOLONE