input word = C00008794

Metabolite InformationStructural formula
Name Daphnodorin A
Formula C30H22O9
Mw 526.1263823
CAS RN 95733-03-2
C_ID C00008794 ,
InChIKey SFIBBWQCUADULX-QWVACARCNA-N
InChICode InChI=1S/C30H22O9/c31-16-5-1-14(2-6-16)23-10-9-19-20(34)13-24-26(30(19)38-23)27(29(39-24)15-3-7-17(32)8-4-15)28(37)25-21(35)11-18(33)12-22(25)36/h1-8,11-13,23,31-36H,9-10H2/t23-/m0/s1
SMILES O=C(c1c(O)cc(O)cc1O)c1c(-c2ccc(O)cc2)oc2cc(O)c3c(c12)O[C@H](c1ccc(O)cc1)CC3
Start Substs in Alk. Biosynthesis (Prediction)
Organism
Kingdom Family Species Reference
PlantaeThymelaeaceaeDaphne odora Ref.
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