input word = C00036005

Metabolite InformationStructural formula
Name 3'',4''-Dihydrocapnolactone
Formula C19H20O5
Mw 328.13107375
CAS RN 638166-70-8
C_ID C00036005 ,
InChIKey LABSWNJPBIVCBD-KBQHCPMQNA-N
InChICode InChI=1S/C19H20O5/c1-12(9-16-10-13(2)19(21)23-16)7-8-22-15-5-3-14-4-6-18(20)24-17(14)11-15/h3-7,11,13,16H,8-10H2,1-2H3/b12-7+/t13-,16+/m0/s1
SMILES C/C(=CCOc1ccc2ccc(=O)oc2c1)C[C@@H]1C[C@H](C)C(=O)O1
Start Substs in Alk. Biosynthesis (Prediction)
Organism
Kingdom Family Species Reference
PlantaeRutaceaeMicromelum minutum Ref.
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