HYDROXYEPLERENONE, 6.BETA.-

Details

Stereochemistry	ABSOLUTE
Molecular Formula	C24H30O7
Molecular Weight	430.4908
Optical Activity	UNSPECIFIED
Defined Stereocenters	9 / 9
E/Z Centers	0
Charge	0

SHOW SMILES / InChI

Structure of HYDROXYEPLERENONE, 6.BETA.-

Structure Search

SMILES

COC(=O)[C@@H]1[C@@H](O)C2=CC(=O)CC[C@]2(C)[C@@]34O[C@@H]3C[C@@]5(C)[C@@H](CC[C@@]56CCC(=O)O6)[C@H]14

InChI

InChIKey=DDHQRXOAZNEFKY-LRKJUHPMSA-N

InChI=1S/C24H30O7/c1-21-7-4-12(25)10-14(21)19(27)17(20(28)29-3)18-13-5-8-23(9-6-16(26)31-23)22(13,2)11-15-24(18,21)30-15/h10,13,15,17-19,27H,4-9,11H2,1-3H3/t13-,15+,17-,18+,19-,21-,22-,23+,24+/m0/s1

HIDE SMILES / InChI

Molecular Formula	C24H30O7
Molecular Weight	430.4908
Charge	0
Count

Stereochemistry	ABSOLUTE
Additional Stereochemistry	No
Defined Stereocenters	9 / 9
E/Z Centers	0
Optical Activity	UNSPECIFIED

Approval Year

Substance Class	Chemical Created by `admin` on `Mon Mar 31 22:32:59 GMT 2025` Edited by `admin` on `Mon Mar 31 22:32:59 GMT 2025`
Record UNII	V941WT74X6
Record Status	`Validated (UNII)`
Record Version

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Name

Type

Language

6.BETA.-HYDROXYEPLERENONE

Preferred Name

English

HYDROXYEPLERENONE, 6.BETA.-

Common Name

English

PREGN-4-ENE-7,21-DICARBOXYLIC ACID, 9,11-EPOXY-6,17-DIHYDROXY-3-OXO-, .GAMMA.-LACTONE, METHYL ESTER, (6.BETA.,7.ALPHA.,11.ALPHA.,17.ALPHA.)-

Systematic Name

English

Code System Code Type Description

FDA UNII

V941WT74X6

Created by admin on Mon Mar 31 22:32:59 GMT 2025 , Edited by admin on Mon Mar 31 22:32:59 GMT 2025

PRIMARY

PUBCHEM

29981516

Created by admin on Mon Mar 31 22:32:59 GMT 2025 , Edited by admin on Mon Mar 31 22:32:59 GMT 2025

PRIMARY

CAS

209253-80-5

Created by admin on Mon Mar 31 22:32:59 GMT 2025 , Edited by admin on Mon Mar 31 22:32:59 GMT 2025

PRIMARY

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