input word = C00022319

Metabolite InformationStructural formula
Name ent-15,16-Epoxy-7,13(16),14-labdatrien-18-oic acid
Formula C20H28O3
Mw 316.20384476
CAS RN 142187-41-5
C_ID C00022319 ,
InChIKey IZRLEXPLVWDKBC-HSFHVDEGNA-N
InChICode InChI=1S/C20H28O3/c1-14-5-8-17-19(2,10-4-11-20(17,3)18(21)22)16(14)7-6-15-9-12-23-13-15/h5,9,12-13,16-17H,4,6-8,10-11H2,1-3H3,(H,21,22)/t16-,17+,19+,20+/m1/s1
SMILES C1C[C@@]([C@@H]2[C@@](C1)([C@@H](C(=CC2)C)CCc1cocc1)C)(C(=O)O)C
Start Substs in Alk. Biosynthesis (Prediction)
Organism
Kingdom Family Species Reference
PlantaeAsteraceaeStevia lucida Ref.
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