input word = C00041004

Metabolite InformationStructural formula
Name Humilinolide F
(-)-Humilinolide F
Formula C36H44O13
Mw 684.27819149
CAS RN 220862-00-0
C_ID C00041004 ,
InChIKey APBIEISWLCINPH-DUJKZNCRNA-N
InChICode InChI=1S/C36H44O13/c1-10-17(2)27(40)47-30-32(5,6)25(24(28(41)43-9)45-18(3)37)34(8)21-11-13-33(7)22(15-23(39)46-26(33)20-12-14-44-16-20)35(21)31(49-35)36(30,29(34)42)48-19(4)38/h10,12,14,16,21-22,24-26,30-31H,11,13,15H2,1-9H3/b17-10+/t21-,22+,24-,25+,26+,30+,31-,33-,34-,35+,36+/m1/s1
SMILES C/C=C(C)C(=O)O[C@H]1C(C)(C)[C@H]([C@@H](OC(C)=O)C(=O)OC)[C@]2(C)C(=O)[C@@]1(OC(C)=O)[C@@H]1O[C@]13[C@@H]2CC[C@@]1(C)[C@H](c2ccoc2)OC(=O)C[C@@H]13
Start Substs in Alk. Biosynthesis (Prediction)
Organism
Kingdom Family Species Reference
PlantaeMeliaceaeSwietenia humilis Zucc. Ref.
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OrganismSwietenia humilis Zucc.
ReferenceJimenez,Phytochem.,49,(1998),1981