input word = C00009572

Metabolite InformationStructural formula
Name Isomillettone
Formula C22H18O6
Mw 378.11033831
CAS RN 22256-05-9
C_ID C00009572 ,
InChIKey GMPWOFIFBQYNHH-UHFFFAOYNA-N
InChICode InChI=1S/C22H18O6/c1-10(2)15-6-13-14(27-15)4-3-11-21(23)20-12-5-17-18(26-9-25-17)7-16(12)24-8-19(20)28-22(11)13/h3-5,7,15,19-20H,1,6,8-9H2,2H3/t15-,19-,20+/m1/s1
SMILES C=C(C)C1Cc2c(ccc3c2OC2COc4cc5c(cc4C2C3=O)OCO5)O1
Start Substs in Alk. Biosynthesis (Prediction)
Organism
Kingdom Family Species Reference
PlantaeFabaceaePiscidia erythrina Ref.
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