input word = C00046340

Metabolite InformationStructural formula
Name Quadranoside II
(+)-Quadranoside II
Formula C36H58O11
Mw 666.3979127
CAS RN 267001-53-6
C_ID C00046340 ,
InChIKey YCWVOSKURXIKHC-RFGBZXTCNA-N
InChICode InChI=1S/C36H58O11/c1-17(2)18-9-10-36(31(45)47-30-27(43)26(42)25(41)22(15-37)46-30)12-11-34(5)19(24(18)36)7-8-23-32(3)13-21(40)29(44)33(4,16-38)28(32)20(39)14-35(23,34)6/h18-30,37-44H,1,7-16H2,2-6H3/t18-,19+,20+,21+,22+,23+,24-,25+,26-,27+,28+,29-,30-,32+,33-,34+,35+,36-/m0/s1
SMILES C=C(C)[C@@H]1CC[C@]2(C(=O)O[C@@H]3O[C@H](CO)[C@@H](O)[C@H](O)[C@H]3O)CC[C@]3(C)[C@H](CC[C@@H]4[C@@]5(C)C[C@@H](O)[C@H](O)[C@@](C)(CO)[C@@H]5[C@H](O)C[C@]43C)[C@@H]12
Start Substs in Alk. Biosynthesis (Prediction)
Organism
Kingdom Family Species Reference
PlantaeCombretaceaeCombretum quadrangulare Ref.
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