U.S. Department of Health & Human Services Divider Arrow National Institutes of Health Divider Arrow NCATS

Details

Stereochemistry ABSOLUTE
Molecular Formula C18H24I3N3O9
Molecular Weight 807.1113
Optical Activity UNSPECIFIED
Defined Stereocenters 4 / 4
E/Z Centers 0
Charge 0

SHOW SMILES / InChI
Structure of IOGLUCOL

SMILES

CNC(=O)C1=C(I)C(NC(=O)[C@H](O)[C@@H](O)[C@H](O)[C@H](O)CO)=C(I)C(N(CCO)C(C)=O)=C1I

InChI

InChIKey=MKMHLTWTZQIVCH-SFNQMWQSSA-N
InChI=1S/C18H24I3N3O9/c1-6(27)24(3-4-25)13-10(20)8(17(32)22-2)9(19)12(11(13)21)23-18(33)16(31)15(30)14(29)7(28)5-26/h7,14-16,25-26,28-31H,3-5H2,1-2H3,(H,22,32)(H,23,33)/t7-,14-,15+,16-/m1/s1

HIDE SMILES / InChI

Molecular Formula C18H24I3N3O9
Molecular Weight 807.1113
Charge 0
Count
Stereochemistry ABSOLUTE
Additional Stereochemistry No
Defined Stereocenters 4 / 4
E/Z Centers 0
Optical Activity UNSPECIFIED

PubMed

PubMed

TitleDatePubMed
Contrast media induced serotonin release in human blood.
1982
Patents
Substance Class Chemical
Created
by admin
on Fri Dec 15 15:40:58 GMT 2023
Edited
by admin
on Fri Dec 15 15:40:58 GMT 2023
Record UNII
ZZU2X307FG
Record Status Validated (UNII)
Record Version
  • Download
Name Type Language
IOGLUCOL
INN   USAN  
INN   USAN  
Official Name English
MP-6026
Code English
3'-(N-(2-HYDROXYETHYL)ACETAMIDO)-2',4',6'-TRIIODO-5'-(METHYLCARBAMOYL)-D-GLUCONANILIDE
Common Name English
D-GLUCONAMIDE, N-(3-(ACETYL(2-HYDROXYETHYL)AMINO)-2,4,6-TRIIODO-5-((METHYLAMINO)CARBONYL)PHENYL)-
Common Name English
ioglucol [INN]
Common Name English
IOGLUCOL [USAN]
Common Name English
Classification Tree Code System Code
NCI_THESAURUS C28500
Created by admin on Fri Dec 15 15:40:58 GMT 2023 , Edited by admin on Fri Dec 15 15:40:58 GMT 2023
Code System Code Type Description
ChEMBL
CHEMBL2104362
Created by admin on Fri Dec 15 15:40:58 GMT 2023 , Edited by admin on Fri Dec 15 15:40:58 GMT 2023
PRIMARY
INN
4653
Created by admin on Fri Dec 15 15:40:58 GMT 2023 , Edited by admin on Fri Dec 15 15:40:58 GMT 2023
PRIMARY
PUBCHEM
20055339
Created by admin on Fri Dec 15 15:40:58 GMT 2023 , Edited by admin on Fri Dec 15 15:40:58 GMT 2023
PRIMARY
NCI_THESAURUS
C80952
Created by admin on Fri Dec 15 15:40:58 GMT 2023 , Edited by admin on Fri Dec 15 15:40:58 GMT 2023
PRIMARY
SMS_ID
100000083635
Created by admin on Fri Dec 15 15:40:58 GMT 2023 , Edited by admin on Fri Dec 15 15:40:58 GMT 2023
PRIMARY
EPA CompTox
DTXSID401024308
Created by admin on Fri Dec 15 15:40:58 GMT 2023 , Edited by admin on Fri Dec 15 15:40:58 GMT 2023
PRIMARY
CAS
63941-73-1
Created by admin on Fri Dec 15 15:40:58 GMT 2023 , Edited by admin on Fri Dec 15 15:40:58 GMT 2023
PRIMARY
EVMPD
SUB08224MIG
Created by admin on Fri Dec 15 15:40:58 GMT 2023 , Edited by admin on Fri Dec 15 15:40:58 GMT 2023
PRIMARY
FDA UNII
ZZU2X307FG
Created by admin on Fri Dec 15 15:40:58 GMT 2023 , Edited by admin on Fri Dec 15 15:40:58 GMT 2023
PRIMARY
Related Record Type Details
ACTIVE MOIETY