input word = C00022443

Metabolite InformationStructural formula
Name ent-7,13E-Labdadiene-2alpha,15-diol
Formula C20H34O2
Mw 306.25588033
CAS RN 123085-35-8
C_ID C00022443 ,
InChIKey HDOKDSAUCWGBQQ-PTXVKSEGNA-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-/m1/s1
SMILES [C@H]1(CC([C@@H]2[C@](C1)([C@@H](C(=CC2)C)CC/C(=C/CO)/C)C)(C)C)O
Start Substs in Alk. Biosynthesis (Prediction)
Organism
Kingdom Family Species Reference
PlantaeAsteraceaeOphryosporus floribundus Ref.
PlantaeAsteraceaeOphryosporus heptanthus Ref.
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OrganismOphryosporus heptanthus
ReferenceFerracini,Phytochem.,28,(1989),1463