input word = C00051387

Metabolite InformationStructural formula
Name Macedonic acid
Formula C30H46O4
Mw 470.33960996
CAS RN 39022-00-9
C_ID C00051387
InChIKey YGZRMPIEELLDBB-FEIULIRENA-N
InChICode InChI=1S/C30H46O4/c1-25(2)20-10-13-30(7)21(27(20,4)12-11-22(25)31)9-8-18-19-16-28(5,24(33)34)23(32)17-26(19,3)14-15-29(18,30)6/h8-9,20-23,31-32H,10-17H2,1-7H3,(H,33,34)/t20-,21+,22-,23+,26-,27-,28-,29+,30+/m0/s1
SMILES CC1(C)[C@@H](O)CC[C@]2(C)[C@H]3C=CC4=C5C[C@](C)(OC=O)[C@H](O)C[C@]5(C)CC[C@@]4(C)[C@]3(C)CC[C@@H]12
Start Substs in Alk. Biosynthesis (Prediction)
Organism
Kingdom Family Species Reference
PlantaeFabaceaeGlycyrrhiza pallidiflora Ref.
PlantaeFabaceaeGlycyrrhiza yunnanensis Ref.
PlantaeSimaroubaceaeBrucea javanica Ref.
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