2?-Cyclopropyl-11,17,21-trihydroxy-16-methyl-2?H-pregna-2,4-dieno[3,2-c]pyrazol-20-one, (11?,16?)-

Details

Stereochemistry	ABSOLUTE
Molecular Formula	C26H36N2O4
Molecular Weight	440.575
Optical Activity	UNSPECIFIED
Defined Stereocenters	8 / 8
E/Z Centers	0
Charge	0

SHOW SMILES / InChI

Structure of 2?-Cyclopropyl-11,17,21-trihydroxy-16-methyl-2?H-pregna-2,4-dieno[3,2-c]pyrazol-20-one, (11?,16?)-

Structure Search

SMILES

C[C@@H]1C[C@H]2[C@@H]3CCC4=CC5=C(C[C@]4(C)[C@H]3[C@@H](O)C[C@]2(C)[C@@]1(O)C(=O)CO)C=NN5C6CC6

InChI

InChIKey=BMJRWKGCTYGESW-HWDQVDFUSA-N

InChI=1S/C26H36N2O4/c1-14-8-19-18-7-4-16-9-20-15(12-27-28(20)17-5-6-17)10-24(16,2)23(18)21(30)11-25(19,3)26(14,32)22(31)13-29/h9,12,14,17-19,21,23,29-30,32H,4-8,10-11,13H2,1-3H3/t14-,18+,19+,21+,23-,24+,25+,26+/m1/s1

HIDE SMILES / InChI

Molecular Formula	C26H36N2O4
Molecular Weight	440.575
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 17:59:43 GMT 2025` Edited by `admin` on `Mon Mar 31 17:59:43 GMT 2025`
Record UNII	5W4CV97E8E
Record Status	`Validated (UNII)`
Record Version

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Name

Type

Language

2'-Cyclopropyl-11b,17a,21-trihydroxy-16a-methyl-20-oxopregn-4-eno(3,2-c)pyrazole

Preferred Name

English

2?-Cyclopropyl-11,17,21-trihydroxy-16-methyl-2?H-pregna-2,4-dieno[3,2-c]pyrazol-20-one, (11?,16?)-

Systematic Name

English

(11?,16?)-2?-Cyclopropyl-11,17,21-trihydroxy-16-methyl-2?H-pregna-2,4-dieno[3,2-c]pyrazol-20-one

Systematic Name

English

2?H-Pregna-2,4-dieno[3,2-c]pyrazol-20-one, 2?-cyclopropyl-11,17,21-trihydroxy-16-methyl-, (11?,16?)-

Systematic Name

English

Code System Code Type Description

CAS

54941-87-6

Created by admin on Mon Mar 31 17:59:43 GMT 2025 , Edited by admin on Mon Mar 31 17:59:43 GMT 2025

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FDA UNII

5W4CV97E8E

Created by admin on Mon Mar 31 17:59:43 GMT 2025 , Edited by admin on Mon Mar 31 17:59:43 GMT 2025

PRIMARY