input word = C00046074

Metabolite InformationStructural formula
Name Lantanilic acid
(+)-Lantanilic acid
Formula C35H52O6
Mw 568.37638939
CAS RN 60657-41-2
C_ID C00046074 ,
InChIKey HGMVESCHSMFWDD-POENWHAFNA-N
InChICode InChI=1S/C35H52O6/c1-21(2)17-27(36)41-26-19-29(3,4)18-23-22-9-10-25-32(8,31(22,7)13-15-34(23,26)28(37)38)12-11-24-30(5,6)35(39)16-14-33(24,25)20-40-35/h9,17,23-26,39H,10-16,18-20H2,1-8H3,(H,37,38)/t23-,24-,25-,26+,31+,32+,33+,34-,35-/m0/s1
SMILES C(=C(C)C)C(=O)O[C@@H]1CC(C[C@@H]2[C@]1(CC[C@@]1(C2=CC[C@H]2[C@]1(CC[C@@H]1[C@@]32CC[C@](C1(C)C)(O)OC3)C)C)C(=O)O)(C)C
Start Substs in Alk. Biosynthesis (Prediction)
Organism
Kingdom Family Species Reference
PlantaeVerbenaceaeLantana camara L. Ref.
PlantaeVerbenaceaeLippia turbinata Ref.
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