CHEBI:8990 - SN38 glucuronide

Main ChEBI Ontology Automatic Xrefs Reactions Pathways Models
ChEBI Name SN38 glucuronide
ChEBI ID CHEBI:8990
Stars This entity has been manually annotated by a third party.
Supplier Information ChemicalBook:CB1257009, eMolecules:30316209, ZINC000000895297
Download Molfile XML SDF
Formula C28H28N2O11
Net Charge 0
Average Mass 568.530
Monoisotopic Mass 568.16931
InChI InChI=1S/C28H28N2O11/c1-3-12-13-7-11(40-26-22(33)20(31)21(32)23(41-26)25(35)36)5-6-17(13)29-19-14(12)9-30-18(19)8-16-15(24(30)34)10-39-27(37)28(16,38)4-2/h5-8,20-23,26,31-33,38H,3-4,9-10H2,1-2H3,(H,35,36)/t20-,21-,22+,23-,26+,28-/m0/s1
InChIKey SSJQVDUAKDRWTA-CAYKMONMSA-N
SMILES CCc1c2Cn3c(cc4c(COC(=O)[C@]4(O)CC)c3=O)-c2nc2ccc(O[C@@H]3O[C@@H]([C@@H](O)[C@H](O)[C@H]3O)C(O)=O)cc12
ChEBI Ontology
Outgoing SN38 glucuronide (CHEBI:8990) is a pyranoindolizinoquinoline (CHEBI:48626)
Synonyms Sources
SN-38G KEGG COMPOUND
SN38 glucuronide KEGG COMPOUND
Manual Xrefs Databases
C11376 KEGG COMPOUND
HMDB0060511 HMDB
View more database links
Last Modified
28 July 2014