input word = C00038331

Metabolite InformationStructural formula
Name 8-Benzoyloxymutangin
Formula C42H44O13
Mw 756.27819149
CAS RN 1030358-29-2
C_ID C00038331 ,
InChIKey BFFBXPBHYOLSOD-UHFFFAOYNA-N
InChICode InChI=1S/C42H44O13/c1-24-22-31(50-25(2)43)34(51-26(3)44)41(23-49-37(46)28-16-10-7-11-17-28)36(54-39(48)30-20-14-9-15-21-30)33(53-38(47)29-18-12-8-13-19-29)32-35(52-27(4)45)42(24,41)55-40(32,5)6/h7-21,24,31-36H,22-23H2,1-6H3/t24-,31-,32-,33-,34+,35+,36-,41-,42-/m0/s1
SMILES [C@@]12([C@@]3([C@H](C[C@@H]([C@H]1OC(=O)C)OC(=O)C)C)OC([C@@H]([C@@H]([C@@H]2OC(=O)c1ccccc1)OC(=O)c1ccccc1)[C@H]3OC(=O)C)(C)C)COC(=O)c1ccccc1
Start Substs in Alk. Biosynthesis (Prediction)
Organism
Kingdom Family Species Reference
PlantaeCelastraceaeMicrotropis japonica Ref.
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