Search MNXref
 Feedback

Ioversol

PropertiesImage
MNX_IDMNXM57663 Image of MNXM57663
referencechebi:31717
formulaC18H24I3N3O9
global charge0
mol weight807.114
InChIKeyAMDBBAQNWSUWGN-UHFFFAOYSA-N
InChIInChI=1S/C18H24I3N3O9/c19-13-11(17(32)22-3-8(29)5-26)14(20)16(24(1-2-25)10(31)7-28)15(21)12(13)18(33)23-4-9(30)6-27/h8-9,25-30H,1-7H2,(H,22,32)(H,23,33)
SMILESO=C(NCC(O)CO)C1=C(I)C(C(=O)NCC(O)CO)=C(I)C(N(CCO)C(=O)CO)=C1I
MNX internals
InChI (mnx)InChI=1/C18H24I3N3O9/c19-13-11(17(32)22-3-8(29)5-26)14(20)16(24(1-2-25)10(31)7-28)15(21)12(13)18(33)23-4-9(30)6-27/h8-9,25-30H,1-7H2,(H,22,32)(H,23,33)/t8?,9? Image of MNXM57663
SMILES (mnx)[CH2:1]([CH2:2][OH:25])[N:24]([C:10]([CH2:7][OH:28])=[O:31])[C:16]1=[C:14]([I:20])[C:11]([C:17](=[N:22][CH2:3][CH:8]([CH2:5][OH:26])[OH:29])[OH:32])=[C:13]([I:19])[C:12]([C:18](=[N:23][CH2:4][CH:9]([CH2:6][OH:27])[OH:30])[OH:33])=[C:15]1[I:21]
Parent-child relations graph
Occurences in reactions#reac
in my sandbox 0
in MNXref (generic)0
in models (compartimentalized) 0
Similar chemical compounds in external resources
IdentifierDescription

CHEBI:31717
chebi:31717
AMDBBAQNWSUWGN-UHFFFAOYSA-N 		Ioversol
MP-328
Optiray (TN)
joversol

kegg.drug:D01555
keggD:D01555
AMDBBAQNWSUWGN-UHFFFAOYSA-N 		Ioversol (JAN/USP/INN)
Optiray (TN)
hmdb:HMDB0253553
AMDBBAQNWSUWGN-UHFFFAOYSA-N 		Ioversol
N1,N3-Bis(2,3-dihydroxypropyl)-5-[2-hydroxy-N-(2-hydroxyethyl)acetamido]-2,4,6-triiodobenzene-1,3-dicarboximidate
N1,N3-bis(2,3-dihydroxypropyl)-5-[2-hydroxy-N-(2-hydroxyethyl)acetamido]-2,4,6-triiodobenzene-1,3-dicarboxamide
Optiray
Optiray 300
Optiray 320
ioversol

chebi:94420
keggD:M_D01555 		secondary/obsolete/fantasy identifier