input word = C00006287

Metabolite InformationStructural formula
Name 3,8-Di-C-glucopyranosyldiosmetin
Formula C28H32O16
Mw 624.16903498
CAS RN 97218-32-1
C_ID C00006287 ,
InChIKey OZSVEJJFZRCNON-XVMONMNDNA-N
InChICode InChI=1S/C28H32O16/c1-41-12-3-2-8(4-9(12)31)25-17(28-24(40)22(38)19(35)14(7-30)43-28)20(36)15-10(32)5-11(33)16(26(15)44-25)27-23(39)21(37)18(34)13(6-29)42-27/h2-5,13-14,18-19,21-24,27-35,37-40H,6-7H2,1H3/t13-,14+,18+,19+,21-,22-,23+,24+,27-,28-/m0/s1
SMILES COc1ccc(-c2oc3c([C@@H]4OC(CO)[C@@H](O)[C@H](O)C4O)c(O)cc(O)c3c(=O)c2[C@@H]2OC(CO)[C@@H](O)C(O)C2O)cc1O
Start Substs in Alk. Biosynthesis (Prediction)
Organism
Kingdom Family Species Reference
PlantaeRutaceaeCitrus sinensis Ref.
PlantaeRutaceaeCitrus sudachi Ref.
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