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Details

Stereochemistry ABSOLUTE
Molecular Formula C24H29ClO4
Molecular Weight 416.938
Optical Activity UNSPECIFIED
Defined Stereocenters 8 / 8
E/Z Centers 0
Charge 0

SHOW SMILES / InChI
Structure of Cyproterone Acetate

SMILES

[H][C@@]12C[C@]1([H])[C@@]3(C)C(=CC2=O)C(Cl)=C[C@@]4([H])[C@]5([H])CC[C@](OC(C)=O)(C(C)=O)[C@@]5(C)CC[C@]34[H]

InChI

InChIKey=UWFYSQMTEOIJJG-FDTZYFLXSA-N
InChI=1S/C24H29ClO4/c1-12(26)24(29-13(2)27)8-6-16-14-10-20(25)19-11-21(28)15-9-18(15)23(19,4)17(14)5-7-22(16,24)3/h10-11,14-18H,5-9H2,1-4H3/t14-,15+,16-,17-,18-,22-,23-,24-/m0/s1

HIDE SMILES / InChI
Molecular Formula C24H29ClO4
Molecular Weight 416.938
Charge 0
Count
Stereochemistry ABSOLUTE
Additional Stereochemistry No
Defined Stereocenters 8 / 8
E/Z Centers 0
Optical Activity UNSPECIFIED

Approval Year

Unknown
86413
Substance Class Chemical
Created
by admin
on Fri Dec 15 15:09:54 UTC 2023
Edited
by admin
on Fri Dec 15 15:09:54 UTC 2023
Record UNII
4KM2BN5JHF
Record Status Validated (UNII)
Record Version
  • Download
Name Type Language
Cyproterone Acetate
EP   HSDB   JAN   MART.   MI   USAN   WHO-DD  
USAN  
Official Name English
6-Chloro-3,20-dioxo-1β,2β-dihydro-3′H-cyclopropa[1,2]pregna-1,4,6-trien-17-yl acetate
Systematic Name English
CYPROTERONE ACETATE [EP MONOGRAPH]
Common Name English
CYPROTERONE ACETATE [JAN]
Common Name English
NSC-81430
Code English
CYPROTERONE ACETATE [HSDB]
Common Name English
CYPROTERONE ACETATE [USAN]
Common Name English
SH-714
Code English
CYPROSTAT
Brand Name English
Cyproterone acetate [WHO-DD]
Common Name English
CYPROTERONE ACETATE [MI]
Common Name English
ANDROCUR
Brand Name English
(1β,2β)-17-(Acetyloxy)-6-chloro-1,2-dihydro-3′H-cyclopropa[1,2]pregna-1,4,6-triene-3,20-dione
Systematic Name English
6-Chloro-17-hydroxy-1α,2α-methylenepregna-4,6-diene-3,20-dione acetate
Systematic Name English
CYPROTERONE ACETATE [MART.]
Common Name English
SH714
Code English
3′H-Cyclopropa[1,2]pregna-1,4,6-triene-3,20-dione, 17-(acetyloxy)-6-chloro-1,2-dihydro-, (1β,2β)-
Systematic Name English
Cyproterone 17α-acetate
Common Name English
Classification Tree Code System Code
FDA ORPHAN DRUG 3884
Created by admin on Fri Dec 15 15:09:55 UTC 2023 , Edited by admin on Fri Dec 15 15:09:55 UTC 2023
NCI_THESAURUS C146993
Created by admin on Fri Dec 15 15:09:55 UTC 2023 , Edited by admin on Fri Dec 15 15:09:55 UTC 2023
Code System Code Type Description
RXCUI
22054
Created by admin on Fri Dec 15 15:09:55 UTC 2023 , Edited by admin on Fri Dec 15 15:09:55 UTC 2023
PRIMARY RxNorm
ECHA (EC/EINECS)
207-048-3
Created by admin on Fri Dec 15 15:09:55 UTC 2023 , Edited by admin on Fri Dec 15 15:09:55 UTC 2023
PRIMARY
DRUG CENTRAL
766
Created by admin on Fri Dec 15 15:09:55 UTC 2023 , Edited by admin on Fri Dec 15 15:09:55 UTC 2023
PRIMARY
SMS_ID
100000090321
Created by admin on Fri Dec 15 15:09:55 UTC 2023 , Edited by admin on Fri Dec 15 15:09:55 UTC 2023
PRIMARY
NSC
81430
Created by admin on Fri Dec 15 15:09:55 UTC 2023 , Edited by admin on Fri Dec 15 15:09:55 UTC 2023
PRIMARY
EPA CompTox
DTXSID5020366
Created by admin on Fri Dec 15 15:09:55 UTC 2023 , Edited by admin on Fri Dec 15 15:09:55 UTC 2023
PRIMARY
EVMPD
SUB01539MIG
Created by admin on Fri Dec 15 15:09:55 UTC 2023 , Edited by admin on Fri Dec 15 15:09:55 UTC 2023
PRIMARY
MESH
D017373
Created by admin on Fri Dec 15 15:09:55 UTC 2023 , Edited by admin on Fri Dec 15 15:09:55 UTC 2023
PRIMARY
MERCK INDEX
m4041
Created by admin on Fri Dec 15 15:09:55 UTC 2023 , Edited by admin on Fri Dec 15 15:09:55 UTC 2023
PRIMARY Merck Index
HSDB
3592
Created by admin on Fri Dec 15 15:09:55 UTC 2023 , Edited by admin on Fri Dec 15 15:09:55 UTC 2023
PRIMARY
CHEBI
50743
Created by admin on Fri Dec 15 15:09:55 UTC 2023 , Edited by admin on Fri Dec 15 15:09:55 UTC 2023
PRIMARY
PUBCHEM
9880
Created by admin on Fri Dec 15 15:09:55 UTC 2023 , Edited by admin on Fri Dec 15 15:09:55 UTC 2023
PRIMARY
IUPHAR
2865
Created by admin on Fri Dec 15 15:09:55 UTC 2023 , Edited by admin on Fri Dec 15 15:09:55 UTC 2023
PRIMARY
FDA UNII
4KM2BN5JHF
Created by admin on Fri Dec 15 15:09:55 UTC 2023 , Edited by admin on Fri Dec 15 15:09:55 UTC 2023
PRIMARY
NCI_THESAURUS
C1059
Created by admin on Fri Dec 15 15:09:55 UTC 2023 , Edited by admin on Fri Dec 15 15:09:55 UTC 2023
PRIMARY
WIKIPEDIA
CYPROTERONE ACETATE
Created by admin on Fri Dec 15 15:09:55 UTC 2023 , Edited by admin on Fri Dec 15 15:09:55 UTC 2023
PRIMARY
ChEMBL
CHEMBL139835
Created by admin on Fri Dec 15 15:09:55 UTC 2023 , Edited by admin on Fri Dec 15 15:09:55 UTC 2023
PRIMARY
DRUG BANK
DB04839
Created by admin on Fri Dec 15 15:09:55 UTC 2023 , Edited by admin on Fri Dec 15 15:09:55 UTC 2023
PRIMARY
CAS
427-51-0
Created by admin on Fri Dec 15 15:09:55 UTC 2023 , Edited by admin on Fri Dec 15 15:09:55 UTC 2023
PRIMARY
Related Record Type Details
ANDROGEN RECEPTOR
TARGET -> AGONIST
BINDING
Related Record Type Details
Structure of 15.BETA.-HYDROXYCYPROTERONE ACETATE
METABOLITE ACTIVE -> PARENT
Related Record Type Details
Structure of DELMADINONE ACETATE
IMPURITY -> PARENT
Structure of 3,6,20-trioxo-1β,2β-dihydro-3′H-cyclopropa[1,2]pregna-1,4-dien-17-yl acetate
IMPURITY -> PARENT
Structure of (1β,2β)-17-(Acetyloxy)-1,2-dihydro-3′H-cyclopropa[1,2]pregna-1,4,6-triene-3,20-dione
IMPURITY -> PARENT
Structure of 6-Deschloro-6,7-epoxy Cyproterone Acetate
IMPURITY -> PARENT
Structure of 1α-(chloromethyl)-3,6,20-trioxopregn-4-en-17-yl acetate
IMPURITY -> PARENT
Structure of (1α)-17-(Acetyloxy)-6-chloro-1-(chloromethyl)pregna-4,6-diene-3,20-dione
IMPURITY -> PARENT
Structure of 6β-Chloro-7a-hydroxy-6,7-dihydrocyproterone acetate
IMPURITY -> PARENT
Structure of CYPROTERONE
IMPURITY -> PARENT
Structure of PREGNA-1,4-DIENE-3,20-DIONE, 17-HYDROXY-, ACETATE
IMPURITY -> PARENT
Structure of 6-methoxy-3,20-dioxo-1β,2β-dihydro-3′H-cyclopropa[1,2]pregna-1,4,6-trien-17-yl acetate
IMPURITY -> PARENT
Related Record Type Details
Structure of Cyproterone Acetate
ACTIVE MOIETY
NIH
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