input word = C00023327

Metabolite InformationStructural formula
Name 2alpha,3alpha-Dihydroxycativic acid
Formula C20H34O4
Mw 338.24570957
CAS RN 88202-36-2
C_ID C00023327 ,
InChIKey OFZLWKQJQGKQGV-AKISTTJLNA-N
InChICode InChI=1S/C20H34O4/c1-12(10-17(22)23)6-8-14-13(2)7-9-16-19(3,4)18(24)15(21)11-20(14,16)5/h7,12,14-16,18,21,24H,6,8-11H2,1-5H3,(H,22,23)/t12-,14-,15+,16-,18+,20-/m0/s1
SMILES [C@@H]1([C@H](C([C@H]2[C@@](C1)([C@H](C(=CC2)C)CC[C@@H](CC(=O)O)C)C)(C)C)O)O
Start Substs in Alk. Biosynthesis (Prediction)
Organism
Kingdom Family Species Reference
PlantaeAsteraceaeBaccharis petiolata Ref.
PlantaeAsteraceaeBrickellia veronicaefolia Ref.
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OrganismBaccharis petiolata
ReferenceGianello,Phytochem.,29,(1990),656