input word = C00034513

Metabolite InformationStructural formula
Name Fasciculol E
Formula C39H65NO11
Mw 723.45576193
CAS RN 65694-20-4
C_ID C00034513 ,
InChIKey XCIUFBDNARZOSJ-UHFFFAOYNA-N
InChICode InChI=1S/C39H65NO11/c1-34(2)27-12-11-24-25(16-29(44)39(8)23(14-15-38(24,39)7)22(21-41)10-13-28(43)35(3,4)48)37(27,6)17-26(42)33(34)51-31(46)19-36(5,49)18-30(45)40-20-32(47)50-9/h22-23,26-29,33,41-44,48-49H,10-21H2,1-9H3,(H,40,45)/t22-,23+,26-,27+,28+,29+,33-,36+,37-,38+,39-/m0/s1
SMILES COC(=O)CNC(=O)CC(C)(O)CC(=O)OC1C(O)CC2(C)C3=C(CCC2C1(C)C)C1(C)CCC(C(CO)CCC(O)C(C)(C)O)C1(C)C(O)C3
Start Substs in Alk. Biosynthesis (Prediction) Cholesterol
Organism
Kingdom Family Species Reference
--Naematoloma fasciculare Ref.
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OrganismNaematoloma fasciculare
ReferenceMartinez-Luis,Phytochem.,68,(2007),1882