input word = C00012265

Metabolite InformationStructural formula
Name Gigantanolide C
Formula C20H28O6
Mw 364.18858863
CAS RN 112356-38-4
C_ID C00012265 ,
InChIKey KPDUWXZFODLKCA-CQTJGGOZNA-N
InChICode InChI=1S/C20H28O6/c1-5-12(3)19(23)26-18-14(10-21)8-6-7-11(2)9-15-16(17(18)22)13(4)20(24)25-15/h8-9,12,15-18,21-22H,4-7,10H2,1-3H3/b11-9-,14-8-/t12-,15+,16-,17-,18-/m1/s1
SMILES C=C1C(=O)OC2/C=C(C)CC/C=C(/CO)C(OC(=O)C(C)CC)C(O)C12
Start Substs in Alk. Biosynthesis (Prediction)
Organism
Kingdom Family Species Reference
PlantaeAsteraceaeMontanoa gigas Ref.
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OrganismMontanoa gigas
ReferenceRojatkar,J.Chem.Res.(S),(1986),272