input word = C00047165

Metabolite InformationStructural formula
Name Alstiphyllanine A
(-)-Alstiphyllanine A
Formula C24H28N2O5
Mw 424.19982202
CAS RN 1124378-30-8
C_ID C00047165 ,
InChIKey LJZSPOANDHXTKX-GCXCTCDONA-N
InChICode InChI=1S/C24H28N2O5/c1-5-14-12-26(29)18-10-16(14)24(22(28)30-4)19(26)11-23(21(24)31-13(2)27)15-8-6-7-9-17(15)25(3)20(18)23/h5-9,16,18-21H,10-12H2,1-4H3/b14-5+/t16-,18-,19-,20+,21-,23+,24+,26+/m0/s1
SMILES C/C=C1C[N+]2([O-])[C@H]3CC1C1(C(=O)OC)[C@@H](OC(C)=O)[C@]4(C[C@@H]12)c1ccccc1N(C)[C@H]34
Start Substs in Alk. Biosynthesis (Prediction) L-Trp Secologanin
Organism
Kingdom Family Species Reference
PlantaeApocynaceaeAlstonia macrophylla Ref.
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