input word = C00022499

Metabolite InformationStructural formula
Name Methyl ent-16-acetoxy-6,13E-labdadien-15,17-dioate
Formula C24H36O6
Mw 420.25118888
CAS RN
C_ID C00022499 ,
InChIKey RMNXDJMOHAWPAV-UVIGBFIMNA-N
InChICode InChI=1S/C24H36O6/c1-16(25)30-15-17(14-21(26)28-5)8-10-19-18(22(27)29-6)9-11-20-23(2,3)12-7-13-24(19,20)4/h9,11,14,18-20H,7-8,10,12-13,15H2,1-6H3/b17-14+/t18-,19+,20+,24-/m0/s1
SMILES COC(=O)/C=C(CC[C@@H]1[C@@H](C(=O)OC)C=C[C@@H]2C(C)(C)CCC[C@@]12C)COC(C)=O
Start Substs in Alk. Biosynthesis (Prediction)
Organism
Kingdom Family Species Reference
PlantaeAsteraceaeAcritopappus confertus Ref.
zoom in