input word = C00054628

Metabolite InformationStructural formula
Name 10'-Apo-beta-caroten-10'-oic acid
Formula C27H36O2
Mw 392.27153039
CAS RN 6880-01-9
C_ID C00054628
InChIKey VIAXZJZCXWZOOV-KSMLSKHQSA-N
InChICode InChI=1S/C27H36O2/c1-21(11-7-8-12-22(2)17-19-26(28)29)13-9-14-23(3)16-18-25-24(4)15-10-20-27(25,5)6/h7-9,11-14,16-19H,10,15,20H2,1-6H3,(H,28,29)/b8-7+,13-9+,18-16+,19-17+,21-11+,22-12+,23-14+
SMILES CC1=C(/C=C/C(C)=C/C=C/C(C)=C/C=C/C=C(C)/C=C/C(=O)O)C(C)(C)CCC1
Start Substs in Alk. Biosynthesis (Prediction)
Organism
Kingdom Family Species Reference
PlantaeRutaceaeBoronia megastigma Ref.
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