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

Details

Stereochemistry	ABSOLUTE
Molecular Formula	C25H36N2O5
Molecular Weight	444.5637
Optical Activity	UNSPECIFIED
Defined Stereocenters	8 / 8
E/Z Centers	0
Charge	0

SHOW SMILES / InChI

Structure of 2?H-Pregna-2,4-dieno[3,2-c]pyrazol-20-one, 11,17,21-trihydroxy-2?-(2-hydroxyethyl)-16-methyl-, (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=NN5CCO

InChI

InChIKey=FMWRTAPDANMWFK-UTXXINLTSA-N

InChI=1S/C25H36N2O5/c1-14-8-18-17-5-4-16-9-19-15(12-26-27(19)6-7-28)10-23(16,2)22(17)20(30)11-24(18,3)25(14,32)21(31)13-29/h9,12,14,17-18,20,22,28-30,32H,4-8,10-11,13H2,1-3H3/t14-,17+,18+,20+,22-,23+,24+,25+/m1/s1

HIDE SMILES / InChI

Molecular Formula	C25H36N2O5
Molecular Weight	444.5637
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 17:48:00 GMT 2025` Edited by `admin` on `Mon Mar 31 17:48:00 GMT 2025`
Record UNII	4SZJ987Y99
Record Status	`Validated (UNII)`
Record Version

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Language

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

Preferred Name

English

Code System Code Type Description

CAS

55038-88-5

Created by admin on Mon Mar 31 17:48:00 GMT 2025 , Edited by admin on Mon Mar 31 17:48:00 GMT 2025

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FDA UNII

4SZJ987Y99

Created by admin on Mon Mar 31 17:48:00 GMT 2025 , Edited by admin on Mon Mar 31 17:48:00 GMT 2025

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