input word = C00040712

Metabolite InformationStructural formula
Name Xylocarpin D
Formula C35H44O15
Mw 704.26802074
CAS RN 939775-76-5
C_ID C00040712 ,
InChIKey WWFHQTXLMHPBRD-UHFFFAOYNA-N
InChICode InChI=1S/C35H44O15/c1-15(36)46-22-11-21-33(7)26(25(41)30(42)44-8)31(5)14-34(33,50-18(4)39)24(28(31)47-16(2)37)29(48-17(3)38)35(21,43)20-12-23(40)49-27(32(20,22)6)19-9-10-45-13-19/h9-10,13,20-22,24-29,41,43H,11-12,14H2,1-8H3/t20-,21-,22-,24+,25-,26-,27+,28-,29+,31+,32+,33+,34-,35-/m0/s1
SMILES COC(=O)C(O)C1C2(C)CC3(OC(C)=O)C(C2OC(C)=O)C(OC(C)=O)C2(O)C4CC(=O)OC(c5ccoc5)C4(C)C(OC(C)=O)CC2C13C
Start Substs in Alk. Biosynthesis (Prediction)
Organism
Kingdom Family Species Reference
PlantaeMeliaceaeXylocarpus granatum Ref.
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