input word = C00011432

Metabolite InformationStructural formula
Name [3R-(3R*,5S*,6E,9S*)]-3,7,11-trimethyl-1,6,10-dodecatriene-3,5,9-triol 9-acetate
Formula C17H28O4
Mw 296.19875938
CAS RN 101629-24-7
C_ID C00011432 ,
InChIKey AXFCXVIWQKROFQ-KFEPMDEYNA-N
InChICode InChI=1S/C17H28O4/c1-7-17(6,20)11-15(19)9-13(4)10-16(8-12(2)3)21-14(5)18/h7-9,15-16,19-20H,1,10-11H2,2-6H3/b13-9+/t15-,16-,17+/m1/s1
SMILES C(=C[C@H](C/C(=C/[C@H](C[C@](C=C)(O)C)O)/C)OC(=O)C)(C)C
Start Substs in Alk. Biosynthesis (Prediction)
Organism
Kingdom Family Species Reference
PlantaeAsteraceaeSantolina oblongifolia Ref.
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OrganismSantolina oblongifolia
ReferenceBohlmann,Phytochem.,21,(1982),1679

De Pascual Teresa,Phytochem.,25,(1986),185