DELMADINONE

Details

Stereochemistry	ABSOLUTE
Molecular Formula	C21H25ClO3
Molecular Weight	360.874
Optical Activity	UNSPECIFIED
Defined Stereocenters	6 / 6
E/Z Centers	0
Charge	0

SHOW SMILES / InChI

Structure Search

SMILES

[H][C@@]12CC[C@](O)(C(C)=O)[C@@]1(C)CC[C@@]3([H])[C@@]2([H])C=C(Cl)C4=CC(=O)C=C[C@]34C

InChI

InChIKey=ZSAMZEYLGUEVJW-TTYLFXKOSA-N

InChI=1S/C21H25ClO3/c1-12(23)21(25)9-6-16-14-11-18(22)17-10-13(24)4-7-19(17,2)15(14)5-8-20(16,21)3/h4,7,10-11,14-16,25H,5-6,8-9H2,1-3H3/t14-,15+,16+,19-,20+,21+/m1/s1

HIDE SMILES / InChI

Molecular Formula	C21H25ClO3
Molecular Weight	360.874
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 `Fri Dec 15 15:18:26 UTC 2023` Edited by `admin` on `Fri Dec 15 15:18:26 UTC 2023`
Record UNII	WFF40U3U3O
Record Status	`Validated (UNII)`
Record Version

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Name

Type

Language

DELMADINONE

Official Name

English

delmadinone [INN]

Common Name

English

6-CHLORO-17-HYDROXYPREGNA-1,4,6-TRIENE-3,20-DIONE

Systematic Name

English

Classification Tree Code System Code

WHO-VATC

QG03DX91

Created by admin on Fri Dec 15 15:18:27 UTC 2023 , Edited by admin on Fri Dec 15 15:18:27 UTC 2023

Code System Code Type Description

SMS_ID

100000083706

Created by admin on Fri Dec 15 15:18:26 UTC 2023 , Edited by admin on Fri Dec 15 15:18:26 UTC 2023

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CAS

15262-77-8

Created by admin on Fri Dec 15 15:18:26 UTC 2023 , Edited by admin on Fri Dec 15 15:18:26 UTC 2023

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FDA UNII

WFF40U3U3O

Created by admin on Fri Dec 15 15:18:26 UTC 2023 , Edited by admin on Fri Dec 15 15:18:26 UTC 2023

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ChEMBL

CHEMBL2104598

Created by admin on Fri Dec 15 15:18:26 UTC 2023 , Edited by admin on Fri Dec 15 15:18:26 UTC 2023

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EPA CompTox

DTXSID60165088

Created by admin on Fri Dec 15 15:18:26 UTC 2023 , Edited by admin on Fri Dec 15 15:18:26 UTC 2023

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PUBCHEM

10428639

Created by admin on Fri Dec 15 15:18:26 UTC 2023 , Edited by admin on Fri Dec 15 15:18:26 UTC 2023

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MESH

C005928

Created by admin on Fri Dec 15 15:18:26 UTC 2023 , Edited by admin on Fri Dec 15 15:18:26 UTC 2023

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WIKIPEDIA

Delmadinone

Created by admin on Fri Dec 15 15:18:27 UTC 2023 , Edited by admin on Fri Dec 15 15:18:27 UTC 2023

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ECHA (EC/EINECS)

239-306-6

Created by admin on Fri Dec 15 15:18:26 UTC 2023 , Edited by admin on Fri Dec 15 15:18:26 UTC 2023

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NCI_THESAURUS

C169884

Created by admin on Fri Dec 15 15:18:26 UTC 2023 , Edited by admin on Fri Dec 15 15:18:26 UTC 2023

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EVMPD

SUB06954MIG

Created by admin on Fri Dec 15 15:18:26 UTC 2023 , Edited by admin on Fri Dec 15 15:18:26 UTC 2023

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INN

2870

Created by admin on Fri Dec 15 15:18:26 UTC 2023 , Edited by admin on Fri Dec 15 15:18:26 UTC 2023

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Related Record Type Details


					WFF40U3U3O

DELMADINONE

ACTIVE MOIETY