17,21-Dihydroxy-16β-methylpregna-1,4,9(11)-triene-3,20-dione 21-acetate

Details

Stereochemistry	ABSOLUTE
Molecular Formula	C24H30O5
Molecular Weight	398.492
Optical Activity	UNSPECIFIED
Defined Stereocenters	6 / 6
E/Z Centers	0
Charge	0

SHOW SMILES / InChI

Structure of 17,21-Dihydroxy-16β-methylpregna-1,4,9(11)-triene-3,20-dione 21-acetate

Structure Search

SMILES

[H][C@@]12C[C@H](C)[C@](O)(C(=O)COC(C)=O)[C@@]1(C)CC=C3[C@@]2([H])CCC4=CC(=O)C=C[C@]34C

InChI

InChIKey=AAPZMQVULRVUEU-NZDAKWCRSA-N

InChI=1S/C24H30O5/c1-14-11-20-18-6-5-16-12-17(26)7-9-22(16,3)19(18)8-10-23(20,4)24(14,28)21(27)13-29-15(2)25/h7-9,12,14,18,20,28H,5-6,10-11,13H2,1-4H3/t14-,18+,20-,22-,23-,24-/m0/s1

HIDE SMILES / InChI

Molecular Formula	C24H30O5
Molecular Weight	398.492
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 19:59:08 GMT 2023` Edited by `admin` on `Sat Dec 16 19:59:08 GMT 2023`
Record UNII	7NHX2Z32JX
Record Status	`Validated (UNII)`
Record Version

Download

Name

Type

Language

17,21-Dihydroxy-16β-methylpregna-1,4,9(11)-triene-3,20-dione 21-acetate

Systematic Name

English

Pregna-1,4,9(11)-triene-3,20-dione, 21-(acetyloxy)-17-hydroxy-16-methyl-, (16β)-

Systematic Name

English

(16β)-21-(Acetyloxy)-17-hydroxy-16-methylpregna-1,4,9(11)-triene-3,20-dione

Systematic Name

English

[2-[(8S,10S,13S,14S,16S,17R)-17-hydroxy-10,13,16-trimethyl-3-oxo-7,8,12,14,15,16-hexahydro-6h-cyclopenta[a]phenanthren-17-yl]-2-oxoethyl] acetate

Systematic Name

English

21-(Acetyloxy)-17-hydroxy-16b-methyl-pregna-1,4,9(11)-triene-3,20-dione

Systematic Name

English

Code System Code Type Description

PUBCHEM

101901

Created by admin on Sat Dec 16 19:59:08 GMT 2023 , Edited by admin on Sat Dec 16 19:59:08 GMT 2023

PRIMARY

FDA UNII

7NHX2Z32JX

Created by admin on Sat Dec 16 19:59:08 GMT 2023 , Edited by admin on Sat Dec 16 19:59:08 GMT 2023

PRIMARY

CAS

910-99-6

Created by admin on Sat Dec 16 19:59:08 GMT 2023 , Edited by admin on Sat Dec 16 19:59:08 GMT 2023

PRIMARY