input word = C00023273

Metabolite InformationStructural formula
Name ent-8(17),12E,14-Labdatriene-3beta,19-diol
Formula C20H32O2
Mw 304.24023027
CAS RN 81920-04-9
C_ID C00023273 ,
InChIKey QKSJAAYFFAZIIF-UAHSUBCQNA-N
InChICode InChI=1S/C20H32O2/c1-6-14(2)7-9-16-15(3)8-10-17-19(16,4)12-11-18(22)20(17,5)13-21/h6-7,16-18,21-22H,1,3,8-13H2,2,4-5H3/b14-7+/t16-,17+,18-,19-,20+/m1/s1
SMILES C1[C@H]([C@]([C@@H]2[C@](C1)([C@@H](C(=C)CC2)C/C=C(\C)/C=C)C)(CO)C)O
Start Substs in Alk. Biosynthesis (Prediction)
Organism
Kingdom Family Species Reference
PlantaeAsteraceaeMikania alvimii Ref.
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OrganismMikania alvimii
ReferenceBohlmann,Phytochem.,21,(1982),173