6.BETA.,17-DIHYDROXY-3,5-CYCLO-5.ALPHA.,17.ALPHA.-PREGN-20-ENE-21-CARBOXYLIC ACID .GAMMA.-LACTONE

Details

Stereochemistry	ABSOLUTE
Molecular Formula	C22H30O3
Molecular Weight	342.4718
Optical Activity	UNSPECIFIED
Defined Stereocenters	9 / 9
E/Z Centers	0
Charge	0

SHOW SMILES / InChI

Structure of 6.BETA.,17-DIHYDROXY-3,5-CYCLO-5.ALPHA.,17.ALPHA.-PREGN-20-ENE-21-CARBOXYLIC ACID .GAMMA.-LACTONE

Structure Search

SMILES

C[C@]12CC[C@@H]3C[C@]13[C@H](O)C[C@H]4[C@@H]5CC[C@]6(OC(=O)C=C6)[C@@]5(C)CC[C@H]24

InChI

InChIKey=OUBYDRMNFCCAQT-IYDFACBSSA-N

InChI=1S/C22H30O3/c1-19-8-4-16-14(15(19)5-9-21(19)10-6-18(24)25-21)11-17(23)22-12-13(22)3-7-20(16,22)2/h6,10,13-17,23H,3-5,7-9,11-12H2,1-2H3/t13-,14+,15+,16+,17-,19+,20-,21-,22+/m1/s1

HIDE SMILES / InChI

Molecular Formula	C22H30O3
Molecular Weight	342.4718
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 `Tue Apr 01 19:43:19 GMT 2025` Edited by `admin` on `Tue Apr 01 19:43:19 GMT 2025`
Record UNII	C39P2J2358
Record Status	`Validated (UNII)`
Record Version

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Name

Type

Language

6.BETA.,17-DIHYDROXY-3,5-CYCLO-5.ALPHA.,17.ALPHA.-PREGN-20-ENE-21-CARBOXYLIC ACID .GAMMA.-LACTONE

Common Name

English

NSC-63298

Preferred Name

English

3,5-CYCLO-5.ALPHA.,17.ALPHA.-PREGN-20-ENE-21-CARBOXYLIC ACID, 6.BETA.,17-DIHYDROXY-, .GAMMA.-LACTONE

Systematic Name

English

3,5-CYCLOPREGN-20-ENE-21-CARBOXYLIC ACID, 6,17-DIHYDROXY-, .GAMMA.-LACTONE, (3.BETA.,5.ALPHA.,6.BETA.,17.ALPHA.)-

Systematic Name

English

Code System Code Type Description

NSC

63298