input word = C00006741

Metabolite InformationStructural formula
Name Malvidin 3-rhamnoside-5-glucoside
Formula C29H35O16
Mw 639.19251007
CAS RN 53925-29-4
C_ID C00006741 ,
InChIKey GNUHZLJAPZCZJW-QCYOUXFDNA-O
InChICode InChI=1S/C29H34O16/c1-10-20(32)23(35)25(37)28(41-10)44-18-8-13-14(42-27(18)11-4-16(39-2)21(33)17(5-11)40-3)6-12(31)7-15(13)43-29-26(38)24(36)22(34)19(9-30)45-29/h4-8,10,19-20,22-26,28-30,32,34-38H,9H2,1-3H3,(H-,31,33)/p+1/t10-,19+,20+,22-,23-,24+,25+,26+,28+,29-/m1/s1
SMILES c1(cc(c2c(c1)[o+]c(c(c2)O[C@@H]1O[C@@H]([C@@H]([C@H]([C@@H]1O)O)O)C)c1cc(c(c(c1)OC)O)OC)O[C@H]1[C@H]([C@H]([C@@H]([C@@H](O1)CO)O)O)O)O
Start Substs in Alk. Biosynthesis (Prediction)
Organism
Kingdom Family Species Reference
PlantaeFabaceaeCicer pinnatifidum Ref.
PlantaeFabaceaeLathyrus latifolius Ref.
PlantaeFabaceaeLathyrus odoratus Ref.
PlantaeFabaceaePisum sativum Ref.
PlantaeFabaceaeVicia deflexa Ref.
PlantaeFabaceaeVicia pseudo-orobus Ref.
PlantaeFabaceaeVicia unijuga Ref.
PlantaeVitaceaeAmpelopsis brevipedunculata Ref.
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