input word = C00060025

Metabolite InformationStructural formula
Name 1-O-Methylclausenolide
Formula C26H34O8
Mw 474.22536806
CAS RN 148763-15-9
C_ID C00060025
InChIKey NPUPZNLNMKHAFL-YFTCSPJMSA-N
InChICode InChI=1S/C26H34O8/c1-21(2)15-10-16(28)24(5)17(23(15,4)25(6,30-7)34-21)14(27)11-22(3)18(13-8-9-31-12-13)32-20(29)19-26(22,24)33-19/h8-9,12,14-15,17-19,27H,10-11H2,1-7H3/t14-,15-,17+,18-,19+,22-,23-,24+,25-,26+/m0/s1
SMILES COC1(C)OC(C)(C)C2CC(=O)C3(C)C(C(O)CC4(C)C(c5ccoc5)OC(=O)C5OC543)C21C
Start Substs in Alk. Biosynthesis (Prediction)
Organism
Kingdom Family Species Reference
PlantaeRutaceaeClausena excavata Ref.
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