input word = C00057800

Metabolite InformationStructural formula
Name Valylisoleucyllysylprolyl
Formula C22H41N5O5
Mw 455.31076946
CAS RN 1175530-78-5
C_ID C00057800
InChIKey YJCKPRSVGUPZBH-ATIWLJMLSA-N
InChICode InChI=1S/C22H41N5O5/c1-5-14(4)18(26-19(28)17(24)13(2)3)20(29)25-15(9-6-7-11-23)21(30)27-12-8-10-16(27)22(31)32/h13-18H,5-12,23-24H2,1-4H3,(H,25,29)(H,26,28)(H,31,32)/t14-,15-,16-,17-,18-/m0/s1
SMILES CC[C@H](C)[C@H](NC(=O)[C@@H](N)C(C)C)C(=O)N[C@@H](CCCCN)C(=O)N1CCC[C@H]1C(=O)O
Start Substs in Alk. Biosynthesis (Prediction)
Organism
Kingdom Family Species Reference
PlantaeAmaranthaceaeAmaranthus hypochondriacus Ref.
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