input word = C00044057

Metabolite InformationStructural formula
Name 4-Acetylxylomaticin
Formula C39H70O8
Mw 666.50706921
CAS RN 183551-75-9
C_ID C00044057 ,
InChIKey BVKICXIZGULOKS-DVBXWVRTNA-N
InChICode InChI=1S/C39H70O8/c1-4-5-6-7-8-9-10-11-12-13-14-18-24-35(42)37-26-27-38(47-37)36(43)25-20-19-22-33(41)21-16-15-17-23-34(46-31(3)40)29-32-28-30(2)45-39(32)44/h28,30,33-38,41-43H,4-27,29H2,1-3H3/t30-,33+,34+,35+,36+,37+,38+/m0/s1
SMILES C1(=O)C(=C[C@@H](O1)C)C[C@@H](CCCCC[C@H](CCCC[C@H]([C@H]1CC[C@@H](O1)[C@@H](CCCCCCCCCCCCCC)O)O)O)OC(=O)C
Start Substs in Alk. Biosynthesis (Prediction)
Organism
Kingdom Family Species Reference
PlantaeAnnonaceaeAsimina longifolia Ref.
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OrganismAsimina longifolia
ReferenceZafra-Polo,Phytochem.,48,(1998),1087