input word = C00005250

Metabolite InformationStructural formula
Name Grosvenorin
Grosvenorine
Kaempferol 3-rhamnoside-7-glucosyl-(1->2)-rhamnoside
7-[(6-Deoxy-2-O-beta-D-glucopyranosyl-alpha-L-mannopyranosyl)oxy]-3-[(6-deoxy-alpha-L-mannopyranosyl)oxy]-5-hydroxy-2-(4-hydroxyphenyl)-4H-1-benzopyran-4-one
Formula C33H40O19
Mw 740.2163791
CAS RN 156980-60-8
C_ID C00005250 ,
InChIKey FFGGWIVHOGEVSP-MGKJKNBSNA-N
InChICode InChI=1S/C33H40O19/c1-10-19(37)23(41)26(44)31(46-10)51-29-22(40)18-15(36)7-14(8-16(18)49-28(29)12-3-5-13(35)6-4-12)48-33-30(25(43)20(38)11(2)47-33)52-32-27(45)24(42)21(39)17(9-34)50-32/h3-8,10-11,17,19-21,23-27,30-39,41-45H,9H2,1-2H3/t10-,11-,17-,19+,20+,21-,23+,24+,25+,26+,27+,30-,31+,32+,33+/m1/s1
SMILES CC1O[C@@H](Oc2c(-c3ccc(O)cc3)oc3cc(O[C@@H]4OC(C)[C@H](O)[C@H](O)C4O[C@@H]4OC(CO)[C@@H](O)[C@H](O)C4O)cc(O)c3c2=O)[C@@H](O)C(O)[C@H]1O
Start Substs in Alk. Biosynthesis (Prediction)
Organism
Kingdom Family Species Reference
PlantaeCrassulaceaeSedum sarmentosum Ref.
PlantaeCucurbitaceaeSiraitia grosvenori Ref.
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