input word = C00028571

Metabolite InformationStructural formula
Name Melofoline
Formula C26H40N4O5
Mw 488.29987042
CAS RN 107316-95-0
C_ID C00028571 ,
InChIKey YTKIUQMMCNEDNK-BUHFOSPRNA-N
InChICode InChI=1S/C26H40N4O5/c1-8-19-24(32)27-14-13-17-9-11-18(12-10-17)35-23(16(4)5)20(25(33)28-19)29-26(34)21(30(6)7)22(31)15(2)3/h9-16,19-23,31H,8H2,1-7H3,(H,27,32)(H,28,33)(H,29,34)/b14-13+/t19-,20-,21+,22+,23-/m0/s1
SMILES c1cc2ccc1O[C@H]([C@H](NC(=O)[C@H](N(C)C)[C@@H](C(C)C)O)C(=O)N[C@H](C(=O)N/C=C/2)CC)C(C)C
Start Substs in Alk. Biosynthesis (Prediction) L-Tyr
Organism
Kingdom Family Species Reference
PlantaeMalvaceaeMelochia corchorifolia Ref.
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