input word = C00036189

Metabolite InformationStructural formula
Name Pectinolide A
Formula C16H22O6
Mw 310.14163844
CAS RN 149155-54-4
C_ID C00036189 ,
InChIKey ALTFKBHIGVQJSX-RWPLJULONA-N
InChICode InChI=1S/C16H22O6/c1-4-5-6-13(20-11(2)17)7-8-15-14(21-12(3)18)9-10-16(19)22-15/h7-10,13-15H,4-6H2,1-3H3/b8-7-/t13-,14-,15-/m0/s1
SMILES C1(=O)C=C[C@@H]([C@@H](O1)/C=C\[C@H](CCCC)OC(=O)C)OC(=O)C
Start Substs in Alk. Biosynthesis (Prediction)
Organism
Kingdom Family Species Reference
PlantaeLabiataeHyptis pectinata Ref.
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