(16.ALPHA.)-17,21-DIHYDROXY-16-METHYLPREGNA-1,4-DIENE-3,11,20-TRIONE

Details

Stereochemistry	ABSOLUTE
Molecular Formula	C22H28O5
Molecular Weight	372.4547
Optical Activity	UNSPECIFIED
Defined Stereocenters	7 / 7
E/Z Centers	0
Charge	0

SHOW SMILES / InChI

Structure of (16.ALPHA.)-17,21-DIHYDROXY-16-METHYLPREGNA-1,4-DIENE-3,11,20-TRIONE

Structure Search

SMILES

[H][C@@]12C[C@@H](C)[C@](O)(C(=O)CO)[C@@]1(C)CC(=O)[C@@]3([H])[C@@]2([H])CCC4=CC(=O)C=C[C@]34C

InChI

InChIKey=PIDANAQULIKBQS-VUOZLLHNSA-N

InChI=1S/C22H28O5/c1-12-8-16-15-5-4-13-9-14(24)6-7-20(13,2)19(15)17(25)10-21(16,3)22(12,27)18(26)11-23/h6-7,9,12,15-16,19,23,27H,4-5,8,10-11H2,1-3H3/t12-,15+,16+,19-,20+,21+,22+/m1/s1

HIDE SMILES / InChI

Molecular Formula	C22H28O5
Molecular Weight	372.4547
Charge	0
Count

Stereochemistry	ABSOLUTE
Additional Stereochemistry	No
Defined Stereocenters	7 / 7
E/Z Centers	0
Optical Activity	UNSPECIFIED

Approval Year

Substance Class	Chemical Created by `admin` on `Thu Jul 06 21:06:49 UTC 2023` Edited by `admin` on `Thu Jul 06 21:06:49 UTC 2023`
Record UNII	NJ0LL8HN9X
Record Status	`Validated (UNII)`
Record Version

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Name

Type

Language

(16.ALPHA.)-17,21-DIHYDROXY-16-METHYLPREGNA-1,4-DIENE-3,11,20-TRIONE

Systematic Name

English

16.ALPHA.-METHYLPREDNISONE [USP IMPURITY]

Common Name

English

17,21-DIHYDROXY-16.ALPHA.-METHYLPREGNA-1,4-DIENE-3,11,20-TRIONE

Common Name

English

PREGNA-1,4-DIENE-3,11,20-TRIONE, 17,21-DIHYDROXY-16-METHYL-, (16.ALPHA.)-

Systematic Name

English

16.ALPHA.-METHYLPREDNISONE

Common Name

English

Code System Code Type Description

EPA CompTox

DTXSID60738059