input word = C00008795

Metabolite InformationStructural formula
Name Daphnodorin C
Formula C30H22O9
Mw 526.1263823
CAS RN 95733-04-3
C_ID C00008795 ,
InChIKey ISQNBCHHDNWNEQ-HGQXBWPUNA-N
InChICode InChI=1S/C30H22O9/c31-16-5-1-14(2-6-16)22-10-9-19-20(34)13-24-26(27(19)37-22)30(29(38-24)15-3-7-17(32)8-4-15)28(36)25-21(35)11-18(33)12-23(25)39-30/h1-8,11-13,22,29,31-35H,9-10H2/t22-,29-,30+/m0/s1
SMILES c12cc(c3c(c1[C@]1([C@@H](O2)c2ccc(cc2)O)C(=O)c2c(cc(cc2O1)O)O)O[C@@H](CC3)c1ccc(cc1)O)O
Start Substs in Alk. Biosynthesis (Prediction)
Organism
Kingdom Family Species Reference
PlantaeThymelaeaceaeDaphne odora Ref.
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