CHEBI:80923 - Caulerpin

Main ChEBI Ontology Automatic Xrefs Reactions Pathways Models
ChEBI Name Caulerpin
ChEBI ID CHEBI:80923
Stars This entity has been manually annotated by a third party.
Supplier Information
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Formula C24H18N2O4
Net Charge 0
Average Mass 398.41070
Monoisotopic Mass 398.12666
InChI InChI=1S/C24H18N2O4/c1-29-23(27)17-11-15-13-7-3-6-10-20(13)26-22(15)18(24(28)30-2)12-16-14-8-4-5-9-19(14)25-21(16)17/h3-12,25-26H,1-2H3/b15-11-,16-12-,17-11+,18-12+,21-17-,22-18-
InChIKey PVWALMHWUOWPPA-HCOJNGAVSA-N
SMILES COC(=O)C1=C/c2c([nH]c3ccccc23)\C(C(=O)OC)=C/c2c\1[nH]c1ccccc21
ChEBI Ontology
Outgoing Caulerpin (CHEBI:80923) is a indoles (CHEBI:24828)
Manual Xrefs Databases
C00000215 KNApSAcK
C17097 KEGG COMPOUND
View more database links
Registry Number Type Source
26612-48-6 CAS Registry Number KEGG COMPOUND