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Details

Stereochemistry ABSOLUTE
Molecular Formula C41H37ClN6O5
Molecular Weight 729.223
Optical Activity UNSPECIFIED
Defined Stereocenters 1 / 1
E/Z Centers 0
Charge 0

SHOW SMILES / InChI
Structure of CARZELESIN

SMILES

CCN(CC)C1=CC2=C(C=C(O2)C(=O)NC3=CC4=C(NC(=C4)C(=O)N5C[C@@H](CCl)C6=C5C=C(OC(=O)NC7=CC=CC=C7)C8=C6C(C)=CN8)C=C3)C=C1

InChI

InChIKey=BBZDXMBRAFTCAA-AREMUKBSSA-N
InChI=1S/C41H37ClN6O5/c1-4-47(5-2)29-13-11-24-17-35(52-33(24)18-29)39(49)44-28-12-14-30-25(15-28)16-31(46-30)40(50)48-22-26(20-42)37-32(48)19-34(38-36(37)23(3)21-43-38)53-41(51)45-27-9-7-6-8-10-27/h6-19,21,26,43,46H,4-5,20,22H2,1-3H3,(H,44,49)(H,45,51)/t26-/m1/s1

HIDE SMILES / InChI

Molecular Formula C41H37ClN6O5
Molecular Weight 729.223
Charge 0
Count
Stereochemistry ABSOLUTE
Additional Stereochemistry No
Defined Stereocenters 1 / 1
E/Z Centers 0
Optical Activity UNSPECIFIED

Approval Year

Substance Class Chemical
Created
by admin
on Fri Dec 15 16:12:23 UTC 2023
Edited
by admin
on Fri Dec 15 16:12:23 UTC 2023
Record UNII
668UF07O1P
Record Status Validated (UNII)
Record Version
  • Download
Name Type Language
CARZELESIN
INN   USAN  
INN   USAN  
Official Name English
CARZELESIN [USAN]
Common Name English
U-80244
Code English
carzelesin [INN]
Common Name English
NSC-619029
Code English
Classification Tree Code System Code
NCI_THESAURUS C2156
Created by admin on Fri Dec 15 16:12:23 UTC 2023 , Edited by admin on Fri Dec 15 16:12:23 UTC 2023
Code System Code Type Description
MESH
C076570
Created by admin on Fri Dec 15 16:12:23 UTC 2023 , Edited by admin on Fri Dec 15 16:12:23 UTC 2023
PRIMARY
SMS_ID
100000081332
Created by admin on Fri Dec 15 16:12:23 UTC 2023 , Edited by admin on Fri Dec 15 16:12:23 UTC 2023
PRIMARY
EPA CompTox
DTXSID30152602
Created by admin on Fri Dec 15 16:12:23 UTC 2023 , Edited by admin on Fri Dec 15 16:12:23 UTC 2023
PRIMARY
USAN
DD-42
Created by admin on Fri Dec 15 16:12:23 UTC 2023 , Edited by admin on Fri Dec 15 16:12:23 UTC 2023
PRIMARY
NSC
619029
Created by admin on Fri Dec 15 16:12:23 UTC 2023 , Edited by admin on Fri Dec 15 16:12:23 UTC 2023
PRIMARY
FDA UNII
668UF07O1P
Created by admin on Fri Dec 15 16:12:23 UTC 2023 , Edited by admin on Fri Dec 15 16:12:23 UTC 2023
PRIMARY
INN
6927
Created by admin on Fri Dec 15 16:12:23 UTC 2023 , Edited by admin on Fri Dec 15 16:12:23 UTC 2023
PRIMARY
ChEMBL
CHEMBL32911
Created by admin on Fri Dec 15 16:12:23 UTC 2023 , Edited by admin on Fri Dec 15 16:12:23 UTC 2023
PRIMARY
CAS
119813-10-4
Created by admin on Fri Dec 15 16:12:23 UTC 2023 , Edited by admin on Fri Dec 15 16:12:23 UTC 2023
PRIMARY
NCI_THESAURUS
C1441
Created by admin on Fri Dec 15 16:12:23 UTC 2023 , Edited by admin on Fri Dec 15 16:12:23 UTC 2023
PRIMARY
PUBCHEM
3034013
Created by admin on Fri Dec 15 16:12:23 UTC 2023 , Edited by admin on Fri Dec 15 16:12:23 UTC 2023
PRIMARY
EVMPD
SUB06155MIG
Created by admin on Fri Dec 15 16:12:23 UTC 2023 , Edited by admin on Fri Dec 15 16:12:23 UTC 2023
PRIMARY
Related Record Type Details
ACTIVE MOIETY