input word = C00022447

Metabolite InformationStructural formula
Name ent-7,13E-Labdadiene-2beta,15-diol
Formula C20H34O2
Mw 306.25588033
CAS RN 120838-16-6
C_ID C00022447 ,
InChIKey HDOKDSAUCWGBQQ-XFZIGNCWNA-N
InChICode InChI=1S/C20H34O2/c1-14(10-11-21)6-8-17-15(2)7-9-18-19(3,4)12-16(22)13-20(17,18)5/h7,10,16-18,21-22H,6,8-9,11-13H2,1-5H3/b14-10+/t16-,17+,18+,20+/m0/s1
SMILES CC1=CC[C@@H]2C(C)(C)C[C@H](O)C[C@@]2(C)[C@@H]1CC/C(C)=C/CO
Start Substs in Alk. Biosynthesis (Prediction)
Organism
Kingdom Family Species Reference
PlantaeAsteraceaeBaccharis sternbergiana Ref.
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