CHEBI:80419 - Caloxanthin

Main ChEBI Ontology Automatic Xrefs Reactions Pathways Models
ChEBI Name Caloxanthin
ChEBI ID CHEBI:80419
Stars This entity has been manually annotated by a third party.
Supplier Information
Download Molfile XML SDF
Formula C40H56O3
Net Charge 0
Average Mass 584.87080
Monoisotopic Mass 584.423
InChI InChI=1S/C40H56O3/c1-28(17-13-19-30(3)21-23-35-32(5)25-34(41)27-39(35,7)8)15-11-12-16-29(2)18-14-20-31(4)22-24-36-33(6)26-37(42)38(43)40(36,9)10/h11-24,34,37-38,41-43H,25-27H2,1-10H3/b12-11+,17-13+,18-14+,23-21+,24-22+,28-15+,29-16+,30-19+,31-20+/t34-,37-,38+/m1/s1
InChIKey PKHJWTKRKQNNJE-RJLXQHJHSA-N
SMILES CC(\C=C\C=C(C)\C=C\C1=C(C)C[C@@H](O)CC1(C)C)=C/C=C/C=C(C)/C=C/C=C(C)/C=C/C1=C(C)C[C@@H](O)[C@H](O)C1(C)C
ChEBI Ontology
Outgoing Caloxanthin (CHEBI:80419) is a xanthophyll (CHEBI:27325)
Manual Xrefs Databases
C00022906 KNApSAcK
C16282 KEGG COMPOUND
View more database links