CORTOLONE

Details

Stereochemistry	ABSOLUTE
Molecular Formula	C21H34O5
Molecular Weight	366.4917
Optical Activity	UNSPECIFIED
Defined Stereocenters	9 / 9
E/Z Centers	0
Charge	0

SHOW SMILES / InChI

Structure Search

SMILES

[H][C@@]12CC[C@](O)([C@@H](O)CO)[C@@]1(C)CC(=O)[C@@]3([H])[C@@]2([H])CC[C@]4([H])C[C@H](O)CC[C@]34C

InChI

InChIKey=JXCOSKURGJMQSG-AZQJGLEESA-N

InChI=1S/C21H34O5/c1-19-7-5-13(23)9-12(19)3-4-14-15-6-8-21(26,17(25)11-22)20(15,2)10-16(24)18(14)19/h12-15,17-18,22-23,25-26H,3-11H2,1-2H3/t12-,13-,14+,15+,17+,18-,19+,20+,21+/m1/s1

HIDE SMILES / InChI

Molecular Formula	C21H34O5
Molecular Weight	366.4917
Charge	0
Count

Stereochemistry	ABSOLUTE
Additional Stereochemistry	No
Defined Stereocenters	9 / 9
E/Z Centers	0
Optical Activity	UNSPECIFIED

Approval Year

PubMed

Title	Date	PubMed
Analysis of solids, liquids, and biological tissues using solids probe introduction at atmospheric pressure on commercial LC/MS instruments.	2005 Dec 1	16316194

Substance Class	Chemical Created by `admin` on `Sat Dec 16 09:53:13 GMT 2023` Edited by `admin` on `Sat Dec 16 09:53:13 GMT 2023`
Record UNII	3J9D9J550A
Record Status	`Validated (UNII)`
Record Version

Download

Name

Type

Language

CORTOLONE

Common Name

English

CORTOLONE [MI]

Common Name

English

.ALPHA.-CORTOLONE

Common Name

English

PREGNAN-11-ONE, 3,17,20,21-TETRAHYDROXY-, (3.ALPHA.,5.BETA.,20S)-

Systematic Name

English

CORTOLON

Common Name

English

NSC-59872

Code

English

20.ALPHA.-CORTOLONE

Common Name

English

Code System Code Type Description

CAS

516-42-7