input word = C00035433

Metabolite InformationStructural formula
Name Xyloccensin U
Formula C35H44O14
Mw 688.27310612
CAS RN 932740-34-6
C_ID C00035433 ,
InChIKey OCQSEGZYQFQJPG-UHFFFAOYNA-N
InChICode InChI=1S/C35H44O14/c1-16(36)45-24-11-23-33(7)21(12-25(40)43-8)31(5)15-34(33,49-19(4)39)27(29(31)46-17(2)37)30(47-18(3)38)35(23,42)22-13-26(41)48-28(32(22,24)6)20-9-10-44-14-20/h9-10,14,21-24,27-30,42H,11-13,15H2,1-8H3/t21-,22-,23+,24-,27-,28-,29+,30+,31-,32+,33+,34+,35+/m0/s1
SMILES [C@H]1(CC(=O)OC)[C@]2([C@@H]([C@@H]3[C@@]([C@]1([C@@H]1[C@@]([C@@H]3OC(=O)C)([C@@H]3[C@]([C@H](C1)OC(=O)C)([C@@H](OC(=O)C3)c1ccoc1)C)O)C)(C2)OC(=O)C)OC(=O)C)C
Start Substs in Alk. Biosynthesis (Prediction)
Organism
Kingdom Family Species Reference
PlantaeMeliaceaeXylocarpus granatum Ref.
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