input word = C00022245

Metabolite InformationStructural formula
Name 7alpha,8-dihydroxy-5beta,8betaH,9betaH,10alpha-Labdan-15-oic acid
Formula C20H36O4
Mw 340.26135964
CAS RN 14787-33-8
C_ID C00022245 ,
InChIKey LACGHZYLBIIQEJ-ZNKLFJEINA-N
InChICode InChI=1S/C20H36O4/c1-13(11-17(22)23)7-8-14-19(4)10-6-9-18(2,3)15(19)12-16(21)20(14,5)24/h13-16,21,24H,6-12H2,1-5H3,(H,22,23)/t13-,14-,15+,16+,19+,20+/m0/s1
SMILES C1CC([C@@H]2[C@](C1)([C@@H]([C@@]([C@@H](C2)O)(C)O)CC[C@H](C)CC(=O)O)C)(C)C
Start Substs in Alk. Biosynthesis (Prediction)
Organism
Kingdom Family Species Reference
PlantaeSapindaceaeDodonaea lobulata Ref.
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OrganismDodonaea lobulata
ReferenceDawson,Aust. J. Chem.,19,(1966),2133