input word = C00006169

Metabolite InformationStructural formula
Name Isoorientin 6''-O-alpha-L-arabinoside
Formula C26H28O15
Mw 580.14282023
CAS RN 79078-23-2
C_ID C00006169 ,
InChIKey OBBCHAQRWPNBEC-FNUUKFIANA-N
InChICode InChI=1S/C26H28O15/c27-9-2-1-8(3-10(9)28)14-4-11(29)17-15(40-14)5-12(30)18(21(17)34)25-23(36)22(35)20(33)16(41-25)7-39-26-24(37)19(32)13(31)6-38-26/h1-5,13,16,19-20,22-28,30-37H,6-7H2/t13-,16+,19-,20+,22-,23+,24-,25-,26-/m0/s1
SMILES c1(c2c(cc(c1[C@@H]1O[C@@H]([C@H]([C@@H]([C@H]1O)O)O)CO[C@@H]1OC[C@@H]([C@@H]([C@@H]1O)O)O)O)oc(cc2=O)c1ccc(c(c1)O)O)O
Start Substs in Alk. Biosynthesis (Prediction)
Organism
Kingdom Family Species Reference
PlantaeGentianaceaeSwertia perennis Ref.
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