input word = C00009185

Metabolite InformationStructural formula
Name Epimesquitol-(4alpha->6)-epimesquitol-4beta-ol
Formula C30H26O13
Mw 594.13734092
CAS RN
C_ID C00009185 ,
InChIKey BBJGNSJYZVSOQB-OPZWUSKGNA-N
InChICode InChI=1S/C30H26O13/c31-15-4-1-10(7-18(15)34)27-24(39)20(12-3-6-17(33)23(38)29(12)42-27)13-9-14-22(37)25(40)28(43-30(14)26(41)21(13)36)11-2-5-16(32)19(35)8-11/h1-9,20,22,24-25,27-28,31-41H/t20-,22-,24+,25-,27+,28+/m0/s1
SMILES Oc1ccc([C@H]2Oc3c(ccc(O)c3O)[C@@H](c3cc4c(c(O)c3O)O[C@H](c3ccc(O)c(O)c3)[C@H](O)[C@H]4O)[C@H]2O)cc1O
Start Substs in Alk. Biosynthesis (Prediction)
Organism
Kingdom Family Species Reference
PlantaeFabaceaeAcacia melanoxylon Ref.
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