3-Hydroxypregna-5,16-dien-20-one

Details

Stereochemistry	EPIMERIC
Molecular Formula	C21H30O2
Molecular Weight	314.4617
Optical Activity	UNSPECIFIED
Defined Stereocenters	5 / 6
E/Z Centers	0
Charge	0

SHOW SMILES / InChI

Structure of 3-Hydroxypregna-5,16-dien-20-one

Structure Search

SMILES

CC(=O)C1=CC[C@H]2[C@@H]3CC=C4CC(O)CC[C@]4(C)[C@H]3CC[C@]12C

InChI

InChIKey=YLFRRPUBVUAHSR-SRJGTTDWSA-N

InChI=1S/C21H30O2/c1-13(22)17-6-7-18-16-5-4-14-12-15(23)8-10-20(14,2)19(16)9-11-21(17,18)3/h4,6,15-16,18-19,23H,5,7-12H2,1-3H3/t15?,16-,18-,19-,20-,21+/m0/s1

HIDE SMILES / InChI

Molecular Formula	C21H30O2
Molecular Weight	314.4617
Charge	0
Count

Stereochemistry	EPIMERIC
Additional Stereochemistry	No
Defined Stereocenters	5 / 6
E/Z Centers	0
Optical Activity	UNSPECIFIED

Approval Year

Substance Class	Chemical Created by `admin` on `Wed Apr 02 20:23:55 GMT 2025` Edited by `admin` on `Wed Apr 02 20:23:55 GMT 2025`
Record UNII	DST6CH9T43
Record Status	`Validated (UNII)`
Record Version

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Name

Type

Language

Pregna-5,16-dien-20-one, 3-hydroxy-

Preferred Name

English

3-Hydroxypregna-5,16-dien-20-one

Common Name

English

1-[(8R,9S,10R,13S,14S)-3-hydroxy-10,13-dimethyl-2,3,4,7,8,9,11,12,14,15-decahydro-1H-cyclopenta[a]phenanthren-17-yl]ethanone

Systematic Name

English

Code System Code Type Description

FDA UNII

DST6CH9T43

Created by admin on Wed Apr 02 20:23:55 GMT 2025 , Edited by admin on Wed Apr 02 20:23:55 GMT 2025

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CAS

104010-41-5

Created by admin on Wed Apr 02 20:23:55 GMT 2025 , Edited by admin on Wed Apr 02 20:23:55 GMT 2025

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PUBCHEM

12840570

Created by admin on Wed Apr 02 20:23:55 GMT 2025 , Edited by admin on Wed Apr 02 20:23:55 GMT 2025

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