input word = C00042881

Metabolite InformationStructural formula
Name Pulicanadiene A
(+)-Pulicanadiene A
Formula C19H28O6
Mw 352.18858863
CAS RN 851595-64-7
C_ID C00042881 ,
InChIKey DMIGIXZMNGJDMW-TZPMFDLDNA-N
InChICode InChI=1S/C19H28O6/c1-11(2)18-16(24-13(4)20)9-12(3)7-6-8-15(19(22)23)10-17(18)25-14(5)21/h8-9,11,16-18H,6-7,10H2,1-5H3,(H,22,23)/b12-9+,15-8+/t16-,17-,18-/m1/s1
SMILES C\1=C(\C[C@H]([C@@H]([C@@H](/C=C(/CC1)\C)OC(=O)C)C(C)C)OC(=O)C)/C(=O)O
Start Substs in Alk. Biosynthesis (Prediction)
Organism
Kingdom Family Species Reference
PlantaeAsteraceaePulicaria canariensis Ref.
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