input word = C00013824

Metabolite InformationStructural formula
Name 6-Hydroxykaempferol 3-rutinoside
5,6,7,4'-Tetrahydroxyflavonol 3-O-rutinoside
3-[[6-O-(6-Deoxy-alpha-L-mannopyranosyl)-beta-D-glucopyranosyl]oxy]-5,6,7-trihydroxy-2-(4-hydroxyphenyl)-4H-1-benzopyran-4-one
Formula C27H30O16
Mw 610.15338491
CAS RN 205527-00-0
C_ID C00013824 ,
InChIKey QYRJNVCANQPMCH-QWTKRFIBNA-N
InChICode InChI=1S/C27H30O16/c1-8-15(30)20(35)22(37)26(40-8)39-7-13-17(32)21(36)23(38)27(42-13)43-25-19(34)14-12(6-11(29)16(31)18(14)33)41-24(25)9-2-4-10(28)5-3-9/h2-6,8,13,15,17,20-23,26-33,35-38H,7H2,1H3/t8-,13+,15-,17+,20+,21-,22-,23+,26+,27-/m0/s1
SMILES c1c(ccc(c1)O)c1oc2c(c(=O)c1O[C@H]1[C@@H]([C@H]([C@@H]([C@H](O1)CO[C@H]1[C@H]([C@@H]([C@H]([C@@H](O1)C)O)O)O)O)O)O)c(c(c(c2)O)O)O
Start Substs in Alk. Biosynthesis (Prediction)
Organism
Kingdom Family Species Reference
PlantaeDaphniphyllaceaeDaphniphyllum calycinum Ref.
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