input word = C00046546

Metabolite InformationStructural formula
Name 11beta-Acetoxydihydrocedrelone
Formula C28H34O7
Mw 482.23045344
CAS RN 283174-17-4
C_ID C00046546 ,
InChIKey PIWQSPSJNTWMFV-QFASWNBENA-N
InChICode InChI=1S/C28H34O7/c1-14(29)34-17-12-26(5)16(15-8-10-33-13-15)11-19-28(26,35-19)27(6)21(17)25(4)9-7-18(30)24(2,3)22(25)20(31)23(27)32/h8,10,13,16-17,19,21,31H,7,9,11-12H2,1-6H3/t16-,17-,19+,21+,25+,26-,27-,28+/m0/s1
SMILES C1C(=O)C(C2=C(C(=O)[C@@]3([C@@H]([C@]2(C1)C)[C@H](C[C@@]1([C@]23O[C@@H]2C[C@H]1c1cocc1)C)OC(=O)C)C)O)(C)C
Start Substs in Alk. Biosynthesis (Prediction)
Organism
Kingdom Family Species Reference
PlantaeMeliaceaeWalsura yunnanensis Ref.
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