(7.ALPHA.,17.ALPHA.)-17-HYDROXY-3-OXO-7-(OXOACETYL)PREGNA-4,9(11)-DIENE-21-CARBOXYLIC ACID .GAMMA.-LACTONE

Details

Stereochemistry	ABSOLUTE
Molecular Formula	C24H28O5
Molecular Weight	396.4761
Optical Activity	UNSPECIFIED
Defined Stereocenters	6 / 6
E/Z Centers	0
Charge	0

SHOW SMILES / InChI

Structure of (7.ALPHA.,17.ALPHA.)-17-HYDROXY-3-OXO-7-(OXOACETYL)PREGNA-4,9(11)-DIENE-21-CARBOXYLIC ACID .GAMMA.-LACTONE

Structure Search

SMILES

[H][C@@]12CC[C@@]3(CCC(=O)O3)[C@@]1(C)CC=C4[C@@]2([H])[C@@H](CC5=CC(=O)CC[C@]45C)C(=O)C=O

InChI

InChIKey=LPYRZIIENXABSC-IUFLCPJJSA-N

InChI=1S/C24H28O5/c1-22-7-3-15(26)11-14(22)12-16(19(27)13-25)21-17(22)4-8-23(2)18(21)5-9-24(23)10-6-20(28)29-24/h4,11,13,16,18,21H,3,5-10,12H2,1-2H3/t16-,18-,21+,22-,23-,24+/m0/s1

HIDE SMILES / InChI

Molecular Formula	C24H28O5
Molecular Weight	396.4761
Charge	0
Count

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

Approval Year

Substance Class	Chemical Created by `admin` on `Sat Dec 16 18:32:09 GMT 2023` Edited by `admin` on `Sat Dec 16 18:32:09 GMT 2023`
Record UNII	8PJ9GK7FY9
Record Status	`Validated (UNII)`
Record Version

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Name

Type

Language

(7.ALPHA.,17.ALPHA.)-17-HYDROXY-3-OXO-7-(OXOACETYL)PREGNA-4,9(11)-DIENE-21-CARBOXYLIC ACID .GAMMA.-LACTONE

Systematic Name

English

PREGNA-4,9(11)-DIENE-21-CARBOXYLIC ACID, 17-HYDROXY-3-OXO-7-(OXOACETYL)-, .GAMMA.-LACTONE, (7.ALPHA.,17.ALPHA.)-

Systematic Name

English

Code System Code Type Description

CAS

610785-46-1

Created by admin on Sat Dec 16 18:32:09 GMT 2023 , Edited by admin on Sat Dec 16 18:32:09 GMT 2023

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FDA UNII

8PJ9GK7FY9

Created by admin on Sat Dec 16 18:32:09 GMT 2023 , Edited by admin on Sat Dec 16 18:32:09 GMT 2023

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PUBCHEM

58700862

Created by admin on Sat Dec 16 18:32:09 GMT 2023 , Edited by admin on Sat Dec 16 18:32:09 GMT 2023

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