input word = C00006312

Metabolite InformationStructural formula
Name Orientin 4'-O-glucoside-2''-O-rhamnoside
Formula C33H40O20
Mw 756.21129372
CAS RN 87454-41-9
C_ID C00006312 ,
InChIKey WWLPZRSACWPVRA-DYXNTJAWNA-N
InChICode InChI=1S/C33H40O20/c1-9-21(40)24(43)27(46)32(48-9)53-31-26(45)23(42)17(7-34)50-30(31)20-13(38)5-12(37)19-14(39)6-16(49-29(19)20)10-2-3-15(11(36)4-10)51-33-28(47)25(44)22(41)18(8-35)52-33/h2-6,9,17-18,21-28,30-38,40-47H,7-8H2,1H3/t9-,17-,18-,21+,22-,23-,24+,25-,26+,27-,28+,30+,31-,32+,33-/m1/s1
SMILES c1(cc(c2c(c1[C@H]1[C@@H]([C@H]([C@@H]([C@H](O1)CO)O)O)O[C@H]1[C@@H]([C@H]([C@H]([C@H](O1)C)O)O)O)oc(cc2=O)c1cc(c(cc1)O[C@H]1[C@H]([C@@H]([C@@H]([C@H](O1)CO)O)O)O)O)O)O
Start Substs in Alk. Biosynthesis (Prediction)
Organism
Kingdom Family Species Reference
PlantaePassifloraceaePassiflora coactilis Ref.
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