input word = C00006164

Metabolite InformationStructural formula
Name Puerarin 4',6''-diacetate
Formula C25H24O11
Mw 500.13186161
CAS RN 24562-39-8
C_ID C00006164 ,
InChIKey ZYCMROZQHVXPBT-DSJWWHKXNA-N
InChICode InChI=1S/C25H24O11/c1-11(26)33-10-18-21(30)22(31)23(32)25(36-18)19-17(28)8-7-15-20(29)16(9-34-24(15)19)13-3-5-14(6-4-13)35-12(2)27/h3-9,18,21-23,25,28,30-32H,10H2,1-2H3/t18-,21+,22-,23+,25-/m0/s1
SMILES c1(ccc2c(c1[C@@H]1O[C@H]([C@H]([C@@H]([C@H]1O)O)O)COC(=O)C)occ(c2=O)c1ccc(cc1)OC(=O)C)O
Start Substs in Alk. Biosynthesis (Prediction)
Organism
Kingdom Family Species Reference
PlantaeFabaceaePueraria tuberosa Ref.
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