input word = C00045365

Metabolite InformationStructural formula
Name Phebaclavin D
Formula C16H16O7
Mw 320.08960287
CAS RN 416845-72-2
C_ID C00045365 ,
InChIKey LOHUNZDPICOFEB-SOFGYWHQNA-N
InChICode InChI=1S/C16H16O7/c1-8(15(19)22-3)6-11(17)10-7-9-4-5-12(21-2)13(18)14(9)23-16(10)20/h4-7,11,17-18H,1-3H3/b8-6+/t11-/m1/s1
SMILES COC(=O)/C(C)=C/C(O)c1cc2ccc(OC)c(O)c2oc1=O
Start Substs in Alk. Biosynthesis (Prediction)
Organism
Kingdom Family Species Reference
PlantaeRutaceaePhebalium clavatum Ref.
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