input word = C00023115

Metabolite InformationStructural formula
Name Methyl 8'-apo-beta-carotenoate
Formula C31H42O2
Mw 446.31848058
CAS RN 4273-73-8
C_ID C00023115 ,
InChIKey WWGLUXSMFKKERG-SEFCXUIZSA-N
InChICode InChI=1S/C31H42O2/c1-24(14-9-10-15-25(2)18-12-19-28(5)30(32)33-8)16-11-17-26(3)21-22-29-27(4)20-13-23-31(29,6)7/h9-12,14-19,21-22H,13,20,23H2,1-8H3/b10-9+,16-11+,18-12+,22-21+,24-14+,25-15+,26-17+,28-19+
SMILES C(=C\C(=C\C=C\C(=C\C=C\C=C(/C=C/C=C(/C(=O)OC)\C)\C)\C)\C)/C1=C(CCCC1(C)C)C
Start Substs in Alk. Biosynthesis (Prediction)
Organism
Kingdom Family Species Reference
PlantaeBixaceaeBixa orellana Ref.
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