input word = C00046065

Metabolite InformationStructural formula
Name Koetjapic acid
Formula C30H46O4
Mw 470.33960996
CAS RN 142905-27-9
C_ID C00046065 ,
InChIKey ASOUKQDZWGOCBR-HDZILRTCNA-N
InChICode InChI=1S/C30H46O4/c1-19(2)20-10-13-30(7)23(28(20,5)12-11-24(31)32)9-8-21-22-18-27(4,25(33)34)15-14-26(22,3)16-17-29(21,30)6/h8,20,22-23H,1,9-18H2,2-7H3,(H,31,32)(H,33,34)/t20-,22-,23+,26+,27-,28+,29+,30+/m0/s1
SMILES [C@]1(CC[C@]2([C@@H](C1)C1=CC[C@H]3[C@]([C@@]1(CC2)C)(CC[C@H]([C@]3(CCC(=O)O)C)C(=C)C)C)C)(C(=O)O)C
Start Substs in Alk. Biosynthesis (Prediction)
Organism
Kingdom Family Species Reference
PlantaeCelastraceaeMaytenus undata Ref.
PlantaeDilleniaceaeDillenia serrata Ref.
PlantaeMeliaceaeSandoricum indicum Ref.
PlantaeMeliaceaeSandoricum koetjape Ref.
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