input word = C00023393

Metabolite InformationStructural formula
Name ent-15,16-Epoxy-2beta,3beta,19-trihydroxy-18-nor-8(17),13(16),14-labdatriene-12-dione
Formula C19H26O5
Mw 334.17802394
CAS RN 93236-22-7
C_ID C00023393 ,
InChIKey JWPAVAPOANDRMB-GENLGHPHNA-N
InChICode InChI=1S/C19H26O5/c1-11-3-4-14-13(9-20)18(23)17(22)8-19(14,2)15(11)7-16(21)12-5-6-24-10-12/h5-6,10,13-15,17-18,20,22-23H,1,3-4,7-9H2,2H3/t13-,14+,15+,17+,18-,19-/m0/s1
SMILES C=C1CC[C@@H]2[C@H](CO)[C@H](O)[C@H](O)C[C@@]2(C)[C@@H]1CC(=O)c1ccoc1
Start Substs in Alk. Biosynthesis (Prediction)
Organism
Kingdom Family Species Reference
PlantaeAsteraceaeAustroeupatorium inulifolium Ref.
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