input word = C00023932

Metabolite InformationStructural formula
Name Hebelomic acid F
Formula C39H60O11
Mw 704.41356276
CAS RN 167875-44-7
C_ID C00023932 ,
InChIKey BGFUQWFRECLECU-MBCPLXKANA-N
InChICode InChI=1S/C39H60O11/c1-21(40)47-31-27(49-33(44)39(10,46)20-30(42)43)19-36(7)25-16-18-37(8)24(15-17-38(37,9)26(25)12-13-28(36)34(31,3)4)23-11-14-29(35(5,6)45)50-32(23)48-22(2)41/h23-24,27-29,31-32,45-46H,11-20H2,1-10H3,(H,42,43)/t23-,24-,27-,28+,29+,31+,32+,36-,37-,38+,39+/m1/s1
SMILES CC(=O)OC1O[C@H](C(C)(C)O)CC[C@@H]1[C@H]1CCC2(C)C3=C(CC[C@]12C)[C@@]1(C)C[C@@H](OC(=O)C(C)(O)CC(=O)O)[C@H](OC(C)=O)C(C)(C)[C@@H]1CC3
Start Substs in Alk. Biosynthesis (Prediction)
Organism
Kingdom Family Species Reference
FungiHymenogastraceaeHebeloma senescens Ref.
zoom in