input word = C00032025

Metabolite InformationStructural formula
Name Mitrasulgynine
(+)-Mitrasulgynine
Formula C23H28N2O7S
Mw 476.16172199
CAS RN 212264-12-5
C_ID C00032025 ,
InChIKey GSAFLXQFFAEFGE-DTYYPKLONA-N
InChICode InChI=1S/C23H28N2O7S/c1-5-13-11-25-10-9-14-19-16(7-6-8-17(19)31-3)24-20(14)21(25)22(33(27,28)29)18(13)15(12-30-2)23(26)32-4/h6-8,12-13,18,22H,5,9-11H2,1-4H3,(H,27,28,29)/b15-12+/t13-,18+,22+/m1/s1
SMILES C12=[N+](C[C@H]([C@H]([C@@H]1S(=O)(=O)[O-])/C(=C\OC)/C(=O)OC)CC)CCc1c2[nH]c2c1c(ccc2)OC
Start Substs in Alk. Biosynthesis (Prediction) L-Trp Secologanin
Organism
Kingdom Family Species Reference
PlantaeRubiaceaeMitragyna speciosa Ref.
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