input word = C00022311

Metabolite InformationStructural formula
Name ent-15,16-Epoxy-7,13(16),14-labdatriene-2alpha,3beta-diol
Formula C20H30O3
Mw 318.21949482
CAS RN 107389-98-0
C_ID C00022311 ,
InChIKey XVYVBJZMFCKPGM-QTJVXDNVNA-N
InChICode InChI=1S/C20H30O3/c1-13-5-8-17-19(2,3)18(22)16(21)11-20(17,4)15(13)7-6-14-9-10-23-12-14/h5,9-10,12,15-18,21-22H,6-8,11H2,1-4H3/t15-,16+,17-,18-,20-/m1/s1
SMILES CC1=CC[C@@H]2C(C)(C)[C@H](O)[C@@H](O)C[C@@]2(C)[C@@H]1CCc1ccoc1
Start Substs in Alk. Biosynthesis (Prediction)
Organism
Kingdom Family Species Reference
PlantaeAsteraceaeBaccharis salicifolia Ref.
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