input word = C00022368

Metabolite InformationStructural formula
Name 3-Oxomanoyl oxide
Formula C20H34O2
Mw 306.25588033
CAS RN 74523-81-2
C_ID C00022368 ,
InChIKey JJZSRKRSWWPWCJ-FIQFBQTMNA-N
InChICode InChI=1S/C20H34O2/c1-7-18(4)11-8-15-19(5)12-10-16(21)17(2,3)14(19)9-13-20(15,6)22-18/h7,14-16,21H,1,8-13H2,2-6H3/t14-,15+,16+,18-,19-,20+/m0/s1
SMILES C=C[C@@]1(C)CCC2[C@@]3(C)CC[C@@H](O)C(C)(C)C3CC[C@@]2(C)O1
Start Substs in Alk. Biosynthesis (Prediction)
Organism
Kingdom Family Species Reference
PlantaeFabaceaeXylia dolabriformis Ref.
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OrganismXylia dolabriformis
ReferenceLaidlaw,J. Chem. Soc.,(1963),644