input word = C00014345

Metabolite InformationStructural formula
Name Clematin
Clematine
5,7,3'-Trihydroxy-4'-methoxyflavanone 7-beta-L-rhamnosyl-(1->6)-glucoside
Formula C28H34O15
Mw 610.18977042
CAS RN 150172-22-8
C_ID C00014345 ,
InChIKey APSNPMVGBGZYAJ-GYGBYUMONA-N
InChICode InChI=1S/C28H34O15/c1-10-21(32)23(34)25(36)27(40-10)39-9-19-22(33)24(35)26(37)28(43-19)41-12-6-14(30)20-15(31)8-16(42-18(20)7-12)11-3-4-13(29)17(5-11)38-2/h3-7,10,16,19,21-30,32-37H,8-9H2,1-2H3/t10-,16-,19+,21-,22+,23+,24-,25-,26+,27-,28+/m0/s1
SMILES c1(cc2c(c(c1)O)C(=O)C[C@H](O2)c1cc(c(cc1)O)OC)O[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
Start Substs in Alk. Biosynthesis (Prediction)
Organism
Kingdom Family Species Reference
PlantaeRanunculaceaeClematis armandii Ref.
PlantaeRutaceaeLeptothyrsa sprucei Ref.
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OrganismLeptothyrsa sprucei
ReferenceLi,Phytochem.,58,(2001),627