input word = C00006274

Metabolite InformationStructural formula
Name Isoscoparin 2''-O-rhamnoside
Formula C28H32O15
Mw 608.17412036
CAS RN 78570-70-4
C_ID C00006274 ,
InChIKey IFUKPUNEQISNJS-SSTVOJQBNA-N
InChICode InChI=1S/C28H32O15/c1-9-20(33)23(36)25(38)28(40-9)43-27-24(37)21(34)17(8-29)42-26(27)19-13(32)7-16-18(22(19)35)12(31)6-14(41-16)10-3-4-11(30)15(5-10)39-2/h3-7,9,17,20-21,23-30,32-38H,8H2,1-2H3/t9-,17-,20-,21+,23-,24-,25+,26-,27-,28-/m0/s1
SMILES c1(c(c(c2c(c1)oc(cc2=O)c1cc(c(cc1)O)OC)O)[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)O
Start Substs in Alk. Biosynthesis (Prediction)
Organism
Kingdom Family Species Reference
PlantaeCaryophyllaceaeSilene alba Ref.
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OrganismSilene alba
ReferenceHarborne, The Handbook of Natural Flavonoids, 1, (1999), 549,C-glycosylflavones

Van Heerden,Z.Naturforsch.C.,36,(1981),486