input word = C00022423

Metabolite InformationStructural formula
Name Hartwrightia acid
Formula C20H30O4
Mw 334.21440945
CAS RN 79405-83-7
C_ID C00022423 ,
InChIKey XJCVTENZYOPEPX-UHFFFAOYNA-N
InChICode InChI=1S/C20H30O4/c1-12(10-16(21)22)6-7-14-13(2)11-15-17-19(14,3)8-5-9-20(17,4)18(23)24-15/h11-12,14-15,17H,5-10H2,1-4H3,(H,21,22)/t12-,14-,15-,17-,19+,20+/m0/s1
SMILES C1C[C@]2(C(=O)O[C@H]3C=C([C@@H]([C@@](C1)([C@@H]23)C)CC[C@@H](CC(=O)O)C)C)C
Start Substs in Alk. Biosynthesis (Prediction)
Organism
Kingdom Family Species Reference
PlantaeAsteraceaeHartwrightia floridana Ref.
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OrganismHartwrightia floridana
ReferenceBohlmann,Phytochem.,20,(1981),843