input word = C00005230

Metabolite InformationStructural formula
Name Kaempferol 3-sophoroside-7-rhamnoside
Formula C33H40O20
Mw 756.21129372
CAS RN 93098-79-4
C_ID C00005230 ,
InChIKey VRYWDBDPXMHHGE-INIIZFHLNA-N
InChICode InChI=1S/C33H40O20/c1-10-19(38)23(42)26(45)31(47-10)48-13-6-14(37)18-15(7-13)49-28(11-2-4-12(36)5-3-11)29(22(18)41)52-33-30(25(44)21(40)17(9-35)51-33)53-32-27(46)24(43)20(39)16(8-34)50-32/h2-7,10,16-17,19-21,23-27,30-40,42-46H,8-9H2,1H3/t10-,16-,17-,19+,20-,21-,23+,24+,25+,26-,27-,30-,31+,32+,33+/m1/s1
SMILES c1(cc(c2c(c1)oc(c(c2=O)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)CO)O)O)O)c1ccc(cc1)O)O)O[C@H]1[C@@H]([C@H]([C@H]([C@H](O1)C)O)O)O
Start Substs in Alk. Biosynthesis (Prediction)
Organism
Kingdom Family Species Reference
PlantaeAraceaeGymnostachys anceps Ref.
PlantaeAspleniaceaeAsplenium kaulfussii Ref.
PlantaeElaeagnaceaeShepherdia argentea Ref.
PlantaeSolanaceaeSolanum spp. Ref.
PlantaeSolanaceaeSolanum tuberosum Ref.
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