3.BETA.-HYDROXYDESOGESTREL

Details

Stereochemistry	ABSOLUTE
Molecular Formula	C22H30O2
Molecular Weight	326.4724
Optical Activity	UNSPECIFIED
Defined Stereocenters	7 / 7
E/Z Centers	0
Charge	0

SHOW SMILES / InChI

Structure Search

SMILES

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

InChI

InChIKey=ZMLDTNLDYRJTAZ-GDLCRWSOSA-N

InChI=1S/C22H30O2/c1-4-21-13-14(3)20-17-9-7-16(23)12-15(17)6-8-18(20)19(21)10-11-22(21,24)5-2/h2,12,16-20,23-24H,3-4,6-11,13H2,1H3/t16-,17-,18-,19-,20+,21-,22-/m0/s1

HIDE SMILES / InChI

Molecular Formula	C22H30O2
Molecular Weight	326.4724
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 `Mon Mar 31 21:23:15 GMT 2025` Edited by `admin` on `Mon Mar 31 21:23:15 GMT 2025`
Record UNII	G08T10WRV0
Record Status	`Validated (UNII)`
Record Version

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Name

Type

Language

3.BETA.-HYDROXYDESOGESTREL

Common Name

English

DESOGESTREL IMPURITY E

Preferred Name

English

18,19-DINORPREGN-4-EN-20-YNE-3,17-DIOL, 13-ETHYL-11-METHYLENE-, (3.BETA.,17.ALPHA.)-

Common Name

English

DESOGESTREL IMPURITY E [EP IMPURITY]

Common Name

English

13-ETHYL-11-METHYLIDENE-18,19-DINOR-17.ALPHA.-PREGN-4-EN-20-YNE-3.BETA.,17-DIOL

Common Name

English

Code System Code Type Description

SMS_ID

300000052824