17,20,21-TRIHYDROXYPREGN-4-EN-3-ONE, (20R)-

Details

Stereochemistry	ABSOLUTE
Molecular Formula	C21H32O4
Molecular Weight	348.4764
Optical Activity	UNSPECIFIED
Defined Stereocenters	7 / 7
E/Z Centers	0
Charge	0

SHOW SMILES / InChI

Structure of 17,20,21-TRIHYDROXYPREGN-4-EN-3-ONE, (20R)-

Structure Search

SMILES

[H][C@@]12CC[C@](O)([C@H](O)CO)[C@@]1(C)CC[C@@]3([H])[C@@]2([H])CCC4=CC(=O)CC[C@]34C

InChI

InChIKey=XNFSGLNHLVHCFT-RMWFXKKMSA-N

InChI=1S/C21H32O4/c1-19-8-5-14(23)11-13(19)3-4-15-16(19)6-9-20(2)17(15)7-10-21(20,25)18(24)12-22/h11,15-18,22,24-25H,3-10,12H2,1-2H3/t15-,16+,17+,18-,19+,20+,21+/m1/s1

HIDE SMILES / InChI

Molecular Formula	C21H32O4
Molecular Weight	348.4764
Charge	0
Count

Stereochemistry	ABSOLUTE
Additional Stereochemistry	No
Defined Stereocenters	7 / 7
E/Z Centers	0
Optical Activity	UNSPECIFIED

Approval Year

Substance Class	Chemical Created by `admin` on `Sat Dec 16 18:35:01 GMT 2023` Edited by `admin` on `Sat Dec 16 18:35:01 GMT 2023`
Record UNII	0D4P2U6DN8
Record Status	`Validated (UNII)`
Record Version

Download

Name

Type

Language

17,20,21-TRIHYDROXYPREGN-4-EN-3-ONE, (20R)-

Systematic Name

English

PREGN-4-EN-3-ONE, 17,20,21-TRIHYDROXY-, (20R)-

Systematic Name

English

17-(1,2-DIHYDROXYETHYL)-.DELTA.4-ANDROSTEN-3-ON-17.ALPHA.-OL

Common Name

English

4-PREGNENE-17.ALPHA.,20.BETA.,21-TRIOL-3-ONE

Common Name

English

4-PREGNENE-17.ALPHA.,20.BETA.,21-TRIOL-3-ONE [MI]

Common Name

English

Code System Code Type Description

MERCK INDEX

m9120