input word = C00048388

Metabolite InformationStructural formula
Name Fallachromenoic acid
(-)-Fallachromenoic acid
Formula C27H35ClO4
Mw 458.22238732
CAS RN 1131283-56-1
C_ID C00048388 ,
InChIKey AQCCYRBRVYHDDZ-QOLNZVEYNA-N
InChICode InChI=1S/C27H35ClO4/c1-18(2)24(28)12-11-21(26(30)31)10-6-8-19(3)9-7-14-27(5)15-13-22-17-23(29)16-20(4)25(22)32-27/h9-10,13,15-17,24,29H,1,6-8,11-12,14H2,2-5H3,(H,30,31)/b19-9+,21-10-/t24-,27-/m1/s1
SMILES C=C(C)C(Cl)CC/C(=C/CC/C(C)=C/CCC1(C)C=Cc2cc(O)cc(C)c2O1)C(=O)O
Start Substs in Alk. Biosynthesis (Prediction)
Organism
Kingdom Family Species Reference
ChromalveolataSargassaceaeSargassum fallax Ref.
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