CHEBI:181753 - Isopteropodin

Main ChEBI Ontology Automatic Xrefs Reactions Pathways Models
This entity has been annotated by a third party. If you would like more information added to this entry, please contact ChEBI via email or GitHub.
ChEBI Name Isopteropodin
ChEBI ID CHEBI:181753
Stars This entity has been manually annotated by a third party.
Submitter MetaboLights
Supplier Information
Download Molfile XML SDF
Formula C21H24N2O4
Net Charge 0
Average Mass 368.433
Monoisotopic Mass 368.17361
InChI InChI=1S/C21H24N2O4/c1-12-14-10-23-8-7-21(16-5-3-4-6-17(16)22-20(21)25)18(23)9-13(14)15(11-27-12)19(24)26-2/h3-6,11-14,18H,7-10H2,1-2H3,(H,22,25)
InChIKey JMIAZDVHNCCPDM-UHFFFAOYSA-N
SMILES O1C(C2C(CC3N(C2)CCC34C=5C(NC4=O)=CC=CC5)C(=C1)C(OC)=O)C
ChEBI Ontology
Outgoing Isopteropodin (CHEBI:181753) is a indolizines (CHEBI:38485)
IUPAC Name
methyl 1-methyl-2'-oxospiro[1,4a,5,5a,7,8,10,10a-octahydropyrano[3,4-]indolizine-6,3'-1H-indole]-4-carboxylate
Manual Xref Database
88824 ChemSpider
View more database links