input word = C00035430

Metabolite InformationStructural formula
Name Xyloccensin R
(+)-Xyloccensin R
Formula C33H38O15
Mw 674.22107055
CAS RN 864656-75-7
C_ID C00035430 ,
InChIKey FHIHDIOAAUFTAC-VWOAFBJPNA-N
InChICode InChI=1S/C33H38O15/c1-14(34)43-18-11-31-28(5)21(20(37)23(38)41-7)26(3)13-30(28,39)32(40,24(26)44-15(2)35)25-33(31,48-29(6,46-25)47-31)17-10-19(36)45-22(27(17,18)4)16-8-9-42-12-16/h8-10,12,18,20-22,24-25,37,39-40H,11,13H2,1-7H3/t18-,20+,21-,22-,24-,25+,26?,27-,28+,29-,30+,31-,32-,33+/m1/s1
SMILES [C@@]12([C@@]3([C@]([C@H]4[C@]56[C@]1(C[C@H]([C@]1(C5=CC(=O)O[C@@H]1c1cocc1)C)OC(=O)C)O[C@](O6)(O4)C)([C@@H]([C@]([C@H]2[C@@H](C(=O)OC)O)(C3)C)OC(=O)C)O)O)C
Start Substs in Alk. Biosynthesis (Prediction)
Organism
Kingdom Family Species Reference
PlantaeMeliaceaeXylocarpus granatum Ref.
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