input word = C00029493

Metabolite InformationStructural formula
Name 3-Epimaslinic acid
Formula C30H48O4
Mw 472.35526002
CAS RN 26563-68-8
C_ID C00029493 ,
InChIKey MDZKJHQSJHYOHJ-GDPKHIPZNA-N
InChICode InChI=1S/C30H48O4/c1-25(2)12-14-30(24(33)34)15-13-28(6)18(19(30)16-25)8-9-22-27(5)17-20(31)23(32)26(3,4)21(27)10-11-29(22,28)7/h8,19-23,31-32H,9-17H2,1-7H3,(H,33,34)/t19-,20+,21-,22+,23+,27-,28+,29+,30-/m0/s1
SMILES CC1(C)CC[C@]2(C(=O)O)CC[C@]3(C)C(=CC[C@@H]4[C@@]5(C)C[C@@H](O)[C@@H](O)C(C)(C)[C@@H]5CC[C@]43C)[C@@H]2C1
Start Substs in Alk. Biosynthesis (Prediction)
Organism
Kingdom Family Species Reference
PlantaeAraliaceaeCentella asiatica Ref.
PlantaeLabiataePerilla frutescens (L.) Britton var.japonica Hara Ref.
PlantaeLabiataeSalvia officinalis Ref.
zoom in



OrganismPerilla frutescens (L.) Britton var.japonica Hara
ReferenceAkihisa,J.Nat.Med.,60,(2006),331