ALGESTONE ACETOPHENIDE

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NCATS

Details

Stereochemistry	ABSOLUTE
Molecular Formula	C29H36O4
Molecular Weight	448.5937
Optical Activity	UNSPECIFIED
Defined Stereocenters	8 / 8
E/Z Centers	0
Charge	0

SHOW SMILES / InChI

Structure of ALGESTONE ACETOPHENIDE

Structure Search

SMILES

[H][C@@]12C[C@@]3([H])[C@]4([H])CCC5=CC(=O)CC[C@]5(C)[C@@]4([H])CC[C@]3(C)[C@@]1(O[C@@](C)(O2)C6=CC=CC=C6)C(C)=O

InChI

InChIKey=AHBKIEXBQNRDNL-FVCOMRFXSA-N

InChI=1S/C29H36O4/c1-18(30)29-25(32-28(4,33-29)19-8-6-5-7-9-19)17-24-22-11-10-20-16-21(31)12-14-26(20,2)23(22)13-15-27(24,29)3/h5-9,16,22-25H,10-15,17H2,1-4H3/t22-,23+,24+,25-,26+,27+,28-,29-/m1/s1

HIDE SMILES / InChI

Molecular Formula	C29H36O4
Molecular Weight	448.5937
Charge	0
Count

Stereochemistry	ABSOLUTE
Additional Stereochemistry	No
Defined Stereocenters	8 / 8
E/Z Centers	0
Optical Activity	UNSPECIFIED

Approval Year

Substance Class	Chemical Created by `admin` on `Fri Dec 15 15:05:33 UTC 2023` Edited by `admin` on `Fri Dec 15 15:05:33 UTC 2023`
Record UNII	OL7KC2O3OT
Record Status	`Validated (UNII)`
Record Version

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Name

Type

Language

ALGESTONE ACETOPHENIDE

Official Name

English

ALGESTONE ACETOPHENIDE [MART.]

Common Name

English

Algestone acetophenide [WHO-DD]

Common Name

English

PREGN-4-ENE-3,20-DIONE, 16,17-((1-PHENYLETHYLIDENE)BIS(OXY))-, (16.ALPHA.(R))-

Common Name

English

SQ 15,101

Code

English

ALGESTONE ACETOPHENIDE [USAN]

Common Name

English

ALGESTONE ACETOPHENIDE [MI]

Common Name

English

(R)-16α,17-Dihydroxypregn-4-ene-3,20-dione cyclic acetal with acetophenone

Common Name

English

DELADROXONE

Brand Name

English

NSC-759863

Code

English

SQ-15101

Code

English

SO-15101

Code

English

Classification Tree Code System Code

NCI_THESAURUS

C776

Created by admin on Fri Dec 15 15:05:33 UTC 2023 , Edited by admin on Fri Dec 15 15:05:33 UTC 2023

Code System Code Type Description

EPA CompTox

DTXSID1022891

Created by admin on Fri Dec 15 15:05:33 UTC 2023 , Edited by admin on Fri Dec 15 15:05:33 UTC 2023

PRIMARY

NCI_THESAURUS

C90968

Created by admin on Fri Dec 15 15:05:33 UTC 2023 , Edited by admin on Fri Dec 15 15:05:33 UTC 2023

PRIMARY

PUBCHEM

5284538

Created by admin on Fri Dec 15 15:05:33 UTC 2023 , Edited by admin on Fri Dec 15 15:05:33 UTC 2023

PRIMARY

NSC

759863

Created by admin on Fri Dec 15 15:05:33 UTC 2023 , Edited by admin on Fri Dec 15 15:05:33 UTC 2023

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SMS_ID

100000077972

Created by admin on Fri Dec 15 15:05:33 UTC 2023 , Edited by admin on Fri Dec 15 15:05:33 UTC 2023

PRIMARY

FDA UNII

OL7KC2O3OT

Created by admin on Fri Dec 15 15:05:33 UTC 2023 , Edited by admin on Fri Dec 15 15:05:33 UTC 2023

PRIMARY

ChEMBL

CHEMBL2105993

Created by admin on Fri Dec 15 15:05:33 UTC 2023 , Edited by admin on Fri Dec 15 15:05:33 UTC 2023

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EVMPD

SUB12773MIG

Created by admin on Fri Dec 15 15:05:33 UTC 2023 , Edited by admin on Fri Dec 15 15:05:33 UTC 2023

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ECHA (EC/EINECS)

246-195-8

Created by admin on Fri Dec 15 15:05:33 UTC 2023 , Edited by admin on Fri Dec 15 15:05:33 UTC 2023

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CAS

24356-94-3

Created by admin on Fri Dec 15 15:05:33 UTC 2023 , Edited by admin on Fri Dec 15 15:05:33 UTC 2023

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WIKIPEDIA

ALGESTONE ACETOPHENIDE

Created by admin on Fri Dec 15 15:05:33 UTC 2023 , Edited by admin on Fri Dec 15 15:05:33 UTC 2023

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MESH

D000463

Created by admin on Fri Dec 15 15:05:33 UTC 2023 , Edited by admin on Fri Dec 15 15:05:33 UTC 2023

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DRUG CENTRAL

797

Created by admin on Fri Dec 15 15:05:33 UTC 2023 , Edited by admin on Fri Dec 15 15:05:33 UTC 2023

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MERCK INDEX

m1503

Created by admin on Fri Dec 15 15:05:33 UTC 2023 , Edited by admin on Fri Dec 15 15:05:33 UTC 2023

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Merck Index

CHEBI

49327

Created by admin on Fri Dec 15 15:05:33 UTC 2023 , Edited by admin on Fri Dec 15 15:05:33 UTC 2023

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					OL7KC2O3OT

ALGESTONE ACETOPHENIDE

ACTIVE MOIETY