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Details

Stereochemistry ABSOLUTE
Molecular Formula 2C17H17N3O6S2.C16H20N2
Molecular Weight 1087.27
Optical Activity UNSPECIFIED
Defined Stereocenters 4 / 4
E/Z Centers 0
Charge 0

SHOW SMILES / InChI
Structure of CEPHAPIRIN BENZATHINE

SMILES

C(CNCC1=CC=CC=C1)NCC2=CC=CC=C2.[H][C@@]4(NC(=O)CSC3=CC=NC=C3)C(=O)N5C(C(O)=O)=C(COC(C)=O)CS[C@]45[H].[H][C@@]7(NC(=O)CSC6=CC=NC=C6)C(=O)N8C(C(O)=O)=C(COC(C)=O)CS[C@]78[H]

InChI

InChIKey=JAHKOXGROZNHHG-RACYMRPCSA-N
InChI=1S/2C17H17N3O6S2.C16H20N2/c2*1-9(21)26-6-10-7-28-16-13(15(23)20(16)14(10)17(24)25)19-12(22)8-27-11-2-4-18-5-3-11;1-3-7-15(8-4-1)13-17-11-12-18-14-16-9-5-2-6-10-16/h2*2-5,13,16H,6-8H2,1H3,(H,19,22)(H,24,25);1-10,17-18H,11-14H2/t2*13-,16-;/m11./s1

HIDE SMILES / InChI

Approval Year

Name Type Language
CEPHAPIRIN BENZATHINE
GREEN BOOK   USP   USP-RS  
Common Name English
CEPHAPIRIN COMPD WITH N,N'-DIBENZYLETHYLENEDIAMINE [MI]
Common Name English
CEFAPIRIN BENZATHINE
Common Name English
CEPHAPIRIN BENZATHINE [USP-RS]
Common Name English
5-THIA-1-AZABICYCLO(4.2.0)OCT-2-ENE-2-CARBOXYLIC ACID, 3-((ACETYLOXY)METHYL)-8-OXO-7-(((4-PYRIDINYLTHIO)ACETYL)AMINO)-, (6R-TRANS)-, COMPD. WITH N,N'-BIS(PHENYLMETHYL)-1,2-ETHANEDIAMINE (2:1)
Common Name English
METRICURE
Brand Name English
CEPHAPIRIN BENZATHINE [GREEN BOOK]
Common Name English
(6R,7R)-3-(HYDROXYMETHYL)-8-OXO-7-(2-(4-PYRIDYLTHIO)ACETAMIDO)-5-THIA-1-AZABICYCLO(4.2.0)OCT-2-ENE-2-CARBOXYLIC ACID COMPOUND WITH N,N'-DIBENZYLETHYLENEDIAMINE (2:1)
Common Name English
CEPHAPIRIN BENZATHINE [USP IMPURITY]
Common Name English
CEPHAPIRIN BENZATHINE [USP MONOGRAPH]
Common Name English
Classification Tree Code System Code
NCI_THESAURUS C357
Created by admin on Fri Dec 15 15:30:50 UTC 2023 , Edited by admin on Fri Dec 15 15:30:50 UTC 2023
CFR 21 CFR 526.363
Created by admin on Fri Dec 15 15:30:50 UTC 2023 , Edited by admin on Fri Dec 15 15:30:50 UTC 2023
Code System Code Type Description
NCI_THESAURUS
C76595
Created by admin on Fri Dec 15 15:30:50 UTC 2023 , Edited by admin on Fri Dec 15 15:30:50 UTC 2023
PRIMARY
MERCK INDEX
m3253
Created by admin on Fri Dec 15 15:30:50 UTC 2023 , Edited by admin on Fri Dec 15 15:30:50 UTC 2023
PRIMARY Merck Index
ChEMBL
CHEMBL1599
Created by admin on Fri Dec 15 15:30:50 UTC 2023 , Edited by admin on Fri Dec 15 15:30:50 UTC 2023
PRIMARY
DAILYMED
90G868409O
Created by admin on Fri Dec 15 15:30:50 UTC 2023 , Edited by admin on Fri Dec 15 15:30:50 UTC 2023
PRIMARY
RS_ITEM_NUM
1102408
Created by admin on Fri Dec 15 15:30:50 UTC 2023 , Edited by admin on Fri Dec 15 15:30:50 UTC 2023
PRIMARY
FDA UNII
90G868409O
Created by admin on Fri Dec 15 15:30:50 UTC 2023 , Edited by admin on Fri Dec 15 15:30:50 UTC 2023
PRIMARY
CAS
97468-37-6
Created by admin on Fri Dec 15 15:30:50 UTC 2023 , Edited by admin on Fri Dec 15 15:30:50 UTC 2023
PRIMARY
RXCUI
1294563
Created by admin on Fri Dec 15 15:30:50 UTC 2023 , Edited by admin on Fri Dec 15 15:30:50 UTC 2023
PRIMARY RxNorm
SMS_ID
300000023718
Created by admin on Fri Dec 15 15:30:50 UTC 2023 , Edited by admin on Fri Dec 15 15:30:50 UTC 2023
PRIMARY
PUBCHEM
167441
Created by admin on Fri Dec 15 15:30:50 UTC 2023 , Edited by admin on Fri Dec 15 15:30:50 UTC 2023
PRIMARY
DRUG BANK
DBSALT001645
Created by admin on Fri Dec 15 15:30:50 UTC 2023 , Edited by admin on Fri Dec 15 15:30:50 UTC 2023
PRIMARY