input word = C00024597

Metabolite InformationStructural formula
Name Singapurensine A
(-)-Singapurensine A
Formula C23H26N2O7
Mw 442.1740012
CAS RN 158182-15-1
C_ID C00024597 ,
InChIKey SGULZRPTCAQSHB-RICUIYGTNA-N
InChICode InChI=1S/C23H26N2O7/c1-30-18(27)23(29)17-20-7-8-22(23)21(9-10-24(16(20)21)15(32-17)11-14(20)26)12-5-3-4-6-13(12)25(22)19(28)31-2/h3-6,14-17,26,29H,7-11H2,1-2H3/t14-,15-,16-,17+,20+,21+,22-,23+/m0/s1
SMILES COC(=O)N1c2ccccc2[C@@]23CCN4[C@@H]5C[C@H](O)C6(CC[C@]12[C@](O)(C(=O)OC)[C@@H]6O5)[C@H]43
Start Substs in Alk. Biosynthesis (Prediction) L-Trp Secologanin
Organism
Kingdom Family Species Reference
PlantaeApocynaceaeKopsia singapurensis Ref.
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