input word = C00024523

Metabolite InformationStructural formula
Name Cathovaline
Cathanneine
Formula C24H30N2O5
Mw 426.21547208
CAS RN 35470-43-0
C_ID C00024523 ,
InChIKey HHQSRWIDLJYBKB-HCVXUVSVNA-N
InChICode InChI=1S/C24H30N2O5/c1-5-22-17-10-12-26-13-11-23(18(22)26)15-8-6-7-9-16(15)25(3)19(23)24(31-17,21(28)29-4)20(22)30-14(2)27/h6-9,17-20H,5,10-13H2,1-4H3/t17?,18-,19+,20-,22-,23+,24+/m0/s1
SMILES c1ccc2c(c1)[C@@]13[C@@H](N2C)[C@@]2([C@H]([C@@]4([C@@H]1N(CC[C@H]4O2)CC3)CC)OC(=O)C)C(=O)OC
Start Substs in Alk. Biosynthesis (Prediction) L-Trp Secologanin
Organism
Kingdom Family Species Reference
PlantaeApocynaceaeCatharanthus lanceus Boj. Ref.
PlantaeApocynaceaeCatharanthus ovalis Ref.
PlantaeApocynaceaeCatharanthus roseus Ref.
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