input word = C00043588

Metabolite InformationStructural formula
Name Hyperibone K
(+)-Hyperibone K
Formula C33H40O4
Mw 500.29265977
CAS RN 819860-70-3
C_ID C00043588 ,
InChIKey HZHJUCBGNDWAOV-UHFFFAOYNA-N
InChICode InChI=1S/C33H40O4/c1-20(2)14-16-31-19-25-24(18-22(5)6)33(28(31)36,26(34)23-12-10-9-11-13-23)29(37)32(27(31)35,30(25,7)8)17-15-21(3)4/h9-15,18,24-25H,16-17,19H2,1-8H3/t24-,25-,31-,32+,33-/m0/s1
SMILES [C@]12(C(=O)[C@@]3(C(=O)[C@](C1=O)(C([C@H]([C@@H]2C=C(C)C)C3)(C)C)CC=C(C)C)CC=C(C)C)C(=O)c1ccccc1
Start Substs in Alk. Biosynthesis (Prediction)
Organism
Kingdom Family Species Reference
PlantaeHypericaceaeHypericum scabrum Ref.
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