input word = C00036009

Metabolite InformationStructural formula
Name Spicoside D
3'-Hydroxyscutellarein 7-O-(6''-O-trans-feruloyl)-beta-glucopyranoside
Formula C28H24O15
Mw 600.1115201
CAS RN 791846-68-9
C_ID C00036009 ,
InChIKey KJMPVIYWCMZMTQ-UXFNJNRLNA-N
InChICode InChI=1S/C28H24O15/c29-12-3-1-10(5-14(12)31)17-7-16(33)21-18(41-17)8-19(22(34)24(21)36)42-28-26(38)25(37)23(35)20(43-28)9-40-27(39)11-2-4-13(30)15(32)6-11/h1-8,20,23,25-26,28-32,34-38H,9H2/t20-,23-,25+,26-,28-/m1/s1
SMILES c1(c(c(c2c(c1)oc(cc2=O)c1cc(c(cc1)O)O)O)O)O[C@H]1[C@@H]([C@H]([C@@H]([C@H](O1)COC(=O)c1ccc(c(c1)O)O)O)O)O
Start Substs in Alk. Biosynthesis (Prediction)
Organism
Kingdom Family Species Reference
PlantaePlantaginaceaeVeronica thymoides subsp.pseudocinerea Ref.
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