input word = C00029380

Metabolite InformationStructural formula
Name 11-Methoxydiaboline
Formula C22H26N2O4
Mw 382.18925733
CAS RN 36151-16-3
C_ID C00029380 ,
InChIKey CWUAKNMXNCKRQK-YWRHVPLJNA-N
InChICode InChI=1S/C22H26N2O4/c1-12(25)24-17-9-14(27-2)3-4-16(17)22-6-7-23-11-13-5-8-28-21(26)19(20(22)24)15(13)10-18(22)23/h3-5,9,15,18-21,26H,6-8,10-11H2,1-2H3/t15-,18-,19+,20-,21+,22+/m0/s1
SMILES [C@@H]12[C@@H](OCC=C3[C@@H]1C[C@H]1[C@@]4([C@H]2N(c2c4ccc(c2)OC)C(=O)C)CCN1C3)O
Start Substs in Alk. Biosynthesis (Prediction) L-Tyr Secologanin
Organism
Kingdom Family Species Reference
PlantaeLonganiaceaeStrychnos brachiata Ref.
PlantaeLonganiaceaeStrychnos lucida Ref.
PlantaeLonganiaceaeStrychnos romeubelenii Ref.
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