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Details

Stereochemistry ABSOLUTE
Molecular Formula C20H26N2O5S
Molecular Weight 406.496
Optical Activity UNSPECIFIED
Defined Stereocenters 3 / 3
E/Z Centers 0
Charge 0

SHOW SMILES / InChI
Structure of ALACEPRIL

SMILES

C[C@H](CSC(C)=O)C(=O)N1CCC[C@H]1C(=O)N[C@@H](CC2=CC=CC=C2)C(O)=O

InChI

InChIKey=FHHHOYXPRDYHEZ-COXVUDFISA-N
InChI=1S/C20H26N2O5S/c1-13(12-28-14(2)23)19(25)22-10-6-9-17(22)18(24)21-16(20(26)27)11-15-7-4-3-5-8-15/h3-5,7-8,13,16-17H,6,9-12H2,1-2H3,(H,21,24)(H,26,27)/t13-,16+,17+/m1/s1

HIDE SMILES / InChI

Molecular Formula C20H26N2O5S
Molecular Weight 406.496
Charge 0
Count
Stereochemistry ABSOLUTE
Additional Stereochemistry No
Defined Stereocenters 3 / 3
E/Z Centers 0
Optical Activity UNSPECIFIED

Approval Year

Substance Class Chemical
Created
by admin
on Fri Dec 15 16:19:04 UTC 2023
Edited
by admin
on Fri Dec 15 16:19:04 UTC 2023
Record UNII
X39TL7JDPF
Record Status Validated (UNII)
Record Version
  • Download
Name Type Language
ALACEPRIL
INN   MART.   MI   WHO-DD  
INN  
Official Name English
ALACEPRIL [MI]
Common Name English
DU-1219
Code English
N-(1-((S)-3-MERCAPTO-2-METHYLPROPIONYL)-L-PROLYL)-3-PHENYL-L-ALANINE ACETATE (ESTER)
Common Name English
alacepril [INN]
Common Name English
1-((2S)-3-(ACETYLTHIO)-2-METHYL-1-OXOPROPYL)-L-PROLYL-L-PHENYLALANINE
Systematic Name English
ALACEPRIL [MART.]
Common Name English
1-(D-3-ACETYLTHIO-2-METHYLPROPANOYL)-L-PROLYL-L-PHENYLALANINE
Common Name English
CETAPRIL
Brand Name English
ALACEPRIL [JAN]
Common Name English
Alacepril [WHO-DD]
Common Name English
NSC-338157
Code English
Classification Tree Code System Code
NCI_THESAURUS C247
Created by admin on Fri Dec 15 16:19:04 UTC 2023 , Edited by admin on Fri Dec 15 16:19:04 UTC 2023
Code System Code Type Description
DRUG CENTRAL
101
Created by admin on Fri Dec 15 16:19:04 UTC 2023 , Edited by admin on Fri Dec 15 16:19:04 UTC 2023
PRIMARY
INN
5458
Created by admin on Fri Dec 15 16:19:04 UTC 2023 , Edited by admin on Fri Dec 15 16:19:04 UTC 2023
PRIMARY
NCI_THESAURUS
C75021
Created by admin on Fri Dec 15 16:19:04 UTC 2023 , Edited by admin on Fri Dec 15 16:19:04 UTC 2023
PRIMARY
MERCK INDEX
m1463
Created by admin on Fri Dec 15 16:19:04 UTC 2023 , Edited by admin on Fri Dec 15 16:19:04 UTC 2023
PRIMARY Merck Index
CAS
74258-86-9
Created by admin on Fri Dec 15 16:19:04 UTC 2023 , Edited by admin on Fri Dec 15 16:19:04 UTC 2023
PRIMARY
WIKIPEDIA
ALACEPRIL
Created by admin on Fri Dec 15 16:19:04 UTC 2023 , Edited by admin on Fri Dec 15 16:19:04 UTC 2023
PRIMARY
MESH
C046835
Created by admin on Fri Dec 15 16:19:04 UTC 2023 , Edited by admin on Fri Dec 15 16:19:04 UTC 2023
PRIMARY
FDA UNII
X39TL7JDPF
Created by admin on Fri Dec 15 16:19:04 UTC 2023 , Edited by admin on Fri Dec 15 16:19:04 UTC 2023
PRIMARY
ChEMBL
CHEMBL2103775
Created by admin on Fri Dec 15 16:19:04 UTC 2023 , Edited by admin on Fri Dec 15 16:19:04 UTC 2023
PRIMARY
EPA CompTox
DTXSID3048576
Created by admin on Fri Dec 15 16:19:04 UTC 2023 , Edited by admin on Fri Dec 15 16:19:04 UTC 2023
PRIMARY
PUBCHEM
71992
Created by admin on Fri Dec 15 16:19:04 UTC 2023 , Edited by admin on Fri Dec 15 16:19:04 UTC 2023
PRIMARY
SMS_ID
100000087692
Created by admin on Fri Dec 15 16:19:04 UTC 2023 , Edited by admin on Fri Dec 15 16:19:04 UTC 2023
PRIMARY
EVMPD
SUB05288MIG
Created by admin on Fri Dec 15 16:19:04 UTC 2023 , Edited by admin on Fri Dec 15 16:19:04 UTC 2023
PRIMARY
NSC
338157
Created by admin on Fri Dec 15 16:19:04 UTC 2023 , Edited by admin on Fri Dec 15 16:19:04 UTC 2023
PRIMARY
Related Record Type Details
METABOLITE -> PARENT
Related Record Type Details
ACTIVE MOIETY