input word = C00045073

Metabolite InformationStructural formula
Name Sorocein L
(+)-Sorocein L
Formula C39H38O9
Mw 650.25158281
CAS RN 507471-24-1
C_ID C00045073 ,
InChIKey QAJFPEYQEDURAN-IXBZVNASNA-N
InChICode InChI=1S/C39H38O9/c1-20-14-27-25-9-8-24(41)19-33(25)47-39(29-10-11-30(42)26(37(29)45)12-13-38(2,3)46)36(27)28(15-20)35-32(44)16-21(17-34(35)48-39)4-5-22-6-7-23(40)18-31(22)43/h4-11,15-19,27-28,36,40-46H,12-14H2,1-3H3/b5-4+/t27-,28+,36-,39+/m1/s1
SMILES c1c(cc2c(c1)[C@@H]1[C@H]3[C@@](O2)(Oc2c([C@@H]3C=C(C1)C)c(cc(c2)/C=C/c1ccc(cc1O)O)O)c1c(c(c(cc1)O)CCC(C)(C)O)O)O
Start Substs in Alk. Biosynthesis (Prediction)
Organism
Kingdom Family Species Reference
PlantaeMoraceaeSorocea ilicifolia Ref.
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