input word = C00039391

Metabolite InformationStructural formula
Name Hyperielliptone HA
(-)-Hyperielliptone HA
Formula C27H40O6
Mw 460.28248901
CAS RN 1033905-28-0
C_ID C00039391 ,
InChIKey ORJPPNKFLPAUGB-ACWIFRLGNA-N
InChICode InChI=1S/C27H40O6/c1-9-15(4)21(28)20-22(29)17(12-18-16(14(2)3)10-11-27(18,8)32)24-26(7,23(20)30)13-19(33-24)25(5,6)31/h15-16,18-19,30-32H,2,9-13H2,1,3-8H3/t15-,16+,18-,19+,26-,27+/m0/s1
SMILES C1(=O)C(=C([C@]2(C(=C1C[C@@H]1[C@@](CC[C@@H]1C(=C)C)(O)C)O[C@H](C2)C(C)(C)O)C)O)C(=O)[C@@H](C)CC
Start Substs in Alk. Biosynthesis (Prediction)
Organism
Kingdom Family Species Reference
PlantaeHypericaceaeHypericum geminiflorum Ref.
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