1-DEHYDROPROGESTERONE

Details

Stereochemistry	ABSOLUTE
Molecular Formula	C21H28O2
Molecular Weight	312.4458
Optical Activity	UNSPECIFIED
Defined Stereocenters	6 / 6
E/Z Centers	0
Charge	0

SHOW SMILES / InChI

Structure Search

SMILES

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

InChI

InChIKey=QIEPWCSVQYUPIY-LEKSSAKUSA-N

InChI=1S/C21H28O2/c1-13(22)17-6-7-18-16-5-4-14-12-15(23)8-10-20(14,2)19(16)9-11-21(17,18)3/h8,10,12,16-19H,4-7,9,11H2,1-3H3/t16-,17+,18-,19-,20-,21+/m0/s1

HIDE SMILES / InChI

Approval Year

PubMed

Title	Date	PubMed
Cooperative inhibition of human thymidylate synthase by mixtures of active site binding and allosteric inhibitors.	2007 Mar 13	17297914

Patents

Name

Type

Language

1-DEHYDROPROGESTERONE

Common Name

English

PREGNA-1,4-DIENE-3,20-DIONE

Systematic Name

English

1,2-DEHYDROPROGESTERONE

Common Name

English

.DELTA.1-PROGESTERONE

Common Name

English

NSC-63538

Code

English

PROGESTERONE IMPURITY J [EP IMPURITY]

Common Name

English

Code System Code Type Description

EPA CompTox

DTXSID50921958