input word = C00033335

Metabolite InformationStructural formula
Name Quadranoside X
(+)-Quadranoside X
Formula C36H58O10
Mw 650.40299807
CAS RN 297141-62-9
C_ID C00033335 ,
InChIKey DFNVNGOVMIJDKY-GRHDMWCINA-N
InChICode InChI=1S/C36H58O10/c1-31(2)11-13-36(30(44)46-29-27(42)26(41)25(40)22(17-37)45-29)14-12-34(5)19(20(36)15-31)7-8-24-32(3)16-21(39)28(43)33(4,18-38)23(32)9-10-35(24,34)6/h21-29,37-43H,7-18H2,1-6H3/t21-,22-,23-,24-,25+,26+,27-,28+,29+,32+,33+,34-,35-,36+/m1/s1
SMILES [C@@H]1([C@@H]([C@]([C@H]2[C@](C1)([C@@H]1[C@@](CC2)([C@]2(C(=C3[C@@](CC2)(CCC(C3)(C)C)C(=O)O[C@@H]2O[C@@H]([C@@H]([C@@H]([C@H]2O)O)O)CO)CC1)C)C)C)(CO)C)O)O
Start Substs in Alk. Biosynthesis (Prediction)
Organism
Kingdom Family Species Reference
PlantaeCombretaceaeCombretum quadrangulare Ref.
zoom in