input word = C00043583

Metabolite InformationStructural formula
Name Hyperibone E
(-)-Hyperibone E
Formula C33H42O7
Mw 550.2930537
CAS RN 407636-34-4
C_ID C00043583 ,
InChIKey RHBKQSJAFOEXDI-ZSWINLDMNA-N
InChICode InChI=1S/C33H42O7/c1-19(2)23(34)16-22-26(36)33(25(35)20-12-10-9-11-13-20)28(37)32(18-24(31(7,8)39)40-27(22)32)17-21(30(33,5)6)14-15-29(3,4)38/h9-15,21,23-24,34,38-39H,1,16-18H2,2-8H3/b15-14+/t21-,23-,24-,32-,33-/m1/s1
SMILES [C@]12(C([C@@H](C[C@@]3(C(=C(C1=O)C[C@@H](O)C(=C)C)O[C@H](C3)C(C)(O)C)C2=O)/C=C/C(C)(C)O)(C)C)C(=O)c1ccccc1
Start Substs in Alk. Biosynthesis (Prediction)
Organism
Kingdom Family Species Reference
PlantaeHypericaceaeHypericum scabrum Ref.
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