input word = C00041789

Metabolite InformationStructural formula
Name Prolifenone A
(+)-Prolifenone A
Formula C31H46O4
Mw 482.33960996
CAS RN 917600-64-7
C_ID C00041789 ,
InChIKey PBOGLNZYQKLFOG-AELOVXPHNA-N
InChICode InChI=1S/C31H46O4/c1-9-23(7)28(34)31-27(33)19-26(32)25(29(31)35)18-24(16-15-21(4)5)30(31,8)17-11-14-22(6)13-10-12-20(2)3/h12,14-15,19,23-25,32H,9-11,13,16-18H2,1-8H3/b22-14+/t23-,24-,25-,30+,31-/m0/s1
SMILES C1=C([C@@H]2C[C@@H]([C@@]([C@](C1=O)(C2=O)C(=O)[C@H](CC)C)(C)CC/C=C(\C)/CCC=C(C)C)CC=C(C)C)O
Start Substs in Alk. Biosynthesis (Prediction)
Organism
Kingdom Family Species Reference
PlantaeHypericaceaeHypericum prolificum L. Ref.
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