input word = C00022732

Metabolite InformationStructural formula
Name 6-Deoxyandalusol
(ent-8alpha)-13(16),14-Labdadiene-8,18-diol
Formula C20H34O2
Mw 306.25588033
CAS RN 70868-53-0
C_ID C00022732 ,
InChIKey UEWVIJOFBJOAGV-TUURZWQTNA-N
InChICode InChI=1S/C20H34O2/c1-6-15(2)8-9-17-19(4)12-7-11-18(3,14-21)16(19)10-13-20(17,5)22/h6,16-17,21-22H,1-2,7-14H2,3-5H3/t16-,17+,18-,19-,20+/m1/s1
SMILES C1C[C@@]([C@@H]2[C@@](C1)([C@@H]([C@](CC2)(O)C)CCC(=C)C=C)C)(CO)C
Start Substs in Alk. Biosynthesis (Prediction)
Organism
Kingdom Family Species Reference
PlantaeLabiataeSideritis arborescens Ref.
PlantaeLabiataeSideritis varoi subsp.oriensis. Ref.
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OrganismSideritis varoi subsp.oriensis.
ReferenceGranodos-Grarcia,Phytochem.,25,(1986),2171