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@@H]1([C@H]([C@H]([C@@H]2[C@](C1)([C@@H](C(=C)CC2)CC(=O)c1cocc1)C)CO)O)O
Start Substs in Alk. Biosynthesis (Prediction)
Organism
Kingdom Family Species Reference
PlantaeAsteraceaeAustroeupatorium inulifolium Ref.
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