input word = C00022752

Metabolite InformationStructural formula
Name Andalusol
Formula C20H34O3
Mw 322.25079495
CAS RN 62279-93-0
C_ID C00022752 ,
InChIKey ZKFWEINMPAYZON-IGJKYZTNNA-N
InChICode InChI=1S/C20H34O3/c1-6-14(2)8-9-16-19(4)11-7-10-18(3,13-21)17(19)15(22)12-20(16,5)23/h6,15-17,21-23H,1-2,7-13H2,3-5H3/t15-,16+,17-,18-,19+,20+/m1/s1
SMILES C1C[C@@]([C@@H]2[C@@](C1)([C@@H]([C@@](C[C@H]2O)(C)O)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