input word = C00012848

Metabolite InformationStructural formula
Name Decahydro-alpha,4a-dimethyl-8-methylene-7-[(2-methyl-1-oxo-2-butenyl)oxy]-2-naphthaleneacetic acid
Formula C20H30O4
Mw 334.21440945
CAS RN 72944-27-5
C_ID C00012848 ,
InChIKey ICZYXHWGOOKQGA-UHFFFAOYNA-N
InChICode InChI=1S/C20H30O4/c1-6-12(2)19(23)24-17-8-10-20(5)9-7-15(13(3)18(21)22)11-16(20)14(17)4/h6,13,15-17H,4,7-11H2,1-3,5H3,(H,21,22)/b12-6+/t13-,15-,16+,17-,20+/m1/s1
SMILES C1[C@]2([C@H](C(=C)[C@@H](C1)OC(=O)/C(=C/C)/C)C[C@@H](CC2)[C@@H](C)C(=O)O)C
Start Substs in Alk. Biosynthesis (Prediction)
Organism
Kingdom Family Species Reference
PlantaeAsteraceaeFlourensia heterolepis Ref.
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