9.ALPHA.,11.BETA.-DICHLORO-16.ALPHA.,17.ALPHA.-ISOPROPYLIDENEDIOXYPREGNA-1,4-DIENE-3,20-DIONE

Details

Stereochemistry	ABSOLUTE
Molecular Formula	C24H30Cl2O4
Molecular Weight	453.399
Optical Activity	UNSPECIFIED
Defined Stereocenters	8 / 8
E/Z Centers	0
Charge	0

SHOW SMILES / InChI

Structure of 9.ALPHA.,11.BETA.-DICHLORO-16.ALPHA.,17.ALPHA.-ISOPROPYLIDENEDIOXYPREGNA-1,4-DIENE-3,20-DIONE

Structure Search

SMILES

CC(=O)[C@@]12OC(C)(C)O[C@@H]1C[C@H]3[C@@H]4CCC5=CC(=O)C=C[C@]5(C)[C@@]4(Cl)[C@@H](Cl)C[C@]23C

InChI

InChIKey=MCDGWBSGFQMQGK-PIQRJGQMSA-N

InChI=1S/C24H30Cl2O4/c1-13(27)24-19(29-20(2,3)30-24)11-17-16-7-6-14-10-15(28)8-9-21(14,4)23(16,26)18(25)12-22(17,24)5/h8-10,16-19H,6-7,11-12H2,1-5H3/t16-,17-,18-,19+,21-,22-,23-,24+/m0/s1

HIDE SMILES / InChI

Molecular Formula	C24H30Cl2O4
Molecular Weight	453.399
Charge	0
Count

Stereochemistry	ABSOLUTE
Additional Stereochemistry	No
Defined Stereocenters	8 / 8
E/Z Centers	0
Optical Activity	UNSPECIFIED

Approval Year

Substance Class	Chemical Created by `admin` on `Mon Mar 31 17:33:35 GMT 2025` Edited by `admin` on `Mon Mar 31 17:33:35 GMT 2025`
Record UNII	031161D80X
Record Status	`Validated (UNII)`
Record Version

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Name

Type

Language

9.ALPHA.,11.BETA.-DICHLORO-16.ALPHA.,17.ALPHA.-ISOPROPYLIDENEDIOXYPREGNA-1,4-DIENE-3,20-DIONE

Common Name

English

PREGNA-1,4-DIENE-3,20-DIONE, 9,11.BETA.-DICHLORO-16.ALPHA.,17-DIHYDROXY-, CYCLIC ACETAL WITH ACETONE

Preferred Name

English

PREGNA-1,4-DIENE-3,20-DIONE, 9,11-DICHLORO-16,17-((1-METHYLETHYLIDENE)BIS(OXY))-, (11.BETA.,16.ALPHA.)-

Systematic Name

English

Code System Code Type Description

FDA UNII

031161D80X

Created by admin on Mon Mar 31 17:33:35 GMT 2025 , Edited by admin on Mon Mar 31 17:33:35 GMT 2025

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CAS

5062-60-2

Created by admin on Mon Mar 31 17:33:35 GMT 2025 , Edited by admin on Mon Mar 31 17:33:35 GMT 2025

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PUBCHEM

109374245

Created by admin on Mon Mar 31 17:33:35 GMT 2025 , Edited by admin on Mon Mar 31 17:33:35 GMT 2025

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