input word = C00022728

Metabolite InformationStructural formula
Name (ent-7alpha,8beta,12E)-12,14-Labdadiene-7,8-diol
Formula C20H34O2
Mw 306.25588033
CAS RN 73496-12-5
C_ID C00022728 ,
InChIKey MVPAUVKWONUNAG-CTIPLAKRNA-N
InChICode InChI=1S/C20H34O2/c1-7-14(2)9-10-15-19(5)12-8-11-18(3,4)16(19)13-17(21)20(15,6)22/h7,9,15-17,21-22H,1,8,10-13H2,2-6H3/b14-9+/t15-,16+,17-,19-,20-/m0/s1
SMILES C1CC([C@@H]2[C@@](C1)([C@@H]([C@]([C@H](C2)O)(C)O)C/C=C(/C=C)\C)C)(C)C
Start Substs in Alk. Biosynthesis (Prediction)
Organism
Kingdom Family Species Reference
PlantaePorellaceaePorella perrottetiana Ref.
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