input word = C00010031

Metabolite InformationStructural formula
Name Crotmarine
Formula C20H20O4
Mw 324.13615913
CAS RN 92662-85-6
C_ID C00010031 ,
InChIKey QSBNBPUPUBDYQE-UHFFFAOYNA-N
InChICode InChI=1S/C20H20O4/c1-11(2)18-7-13-6-16(17(22)9-20(13)24-18)14-5-12-3-4-15(21)8-19(12)23-10-14/h3-4,6,8-9,14,18,21-22H,1,5,7,10H2,2H3/t14-,18-/m0/s1
SMILES c1(ccc2c(c1)OC[C@H](C2)c1cc2c(cc1O)O[C@@H](C2)C(=C)C)O
Start Substs in Alk. Biosynthesis (Prediction)
Organism
Kingdom Family Species Reference
PlantaeFabaceaeCrotalaria madurensis Ref.
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