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CHEBI:95288 - N-[(2S)-4-methyl-1-[[(2S)-4-methyl-1-[[(3S)-5-methyl-2-oxohexan-3-yl]amino]-1-oxopentan-2-yl]amino]-1-oxopentan-2-yl]carbamic acid (phenylmethyl) ester

ChEBI IDCHEBI:95288
ChEBI NameN-[(2S)-4-methyl-1-[[(2S)-4-methyl-1-[[(3S)-5-methyl-2-oxohexan-3-yl]amino]-1-oxopentan-2-yl]amino]-1-oxopentan-2-yl]carbamic acid (phenylmethyl) ester
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DownloadsMolfile
FormulaC27H43N3O5
Net Charge0
Average Mass489.657
Monoisotopic Mass489.32027
SMILESCC(=O)[C@H](CC(C)C)NC(=O)[C@H](CC(C)C)NC(=O)[C@H](CC(C)C)NC(=O)OCc1ccccc1
InChIInChI=1S/C27H43N3O5/c1-17(2)13-22(20(7)31)28-25(32)23(14-18(3)4)29-26(33)24(15-19(5)6)30-27(34)35-16-21-11-9-8-10-12-21/h8-12,17-19,22-24H,13-16H2,1-7H3,(H,28,32)(H,29,33)(H,30,34)/t22-,23-,24-/m0/s1
InChIKeyATFNUSPXCODRJQ-HJOGWXRNSA-N
Roles Classification
Chemical Role:
Bronsted base  A molecular entity capable of accepting a hydron from a donor (Brønsted acid).
ChEBI Ontology
Outgoing Relation(s)
N-[(2S)-4-methyl-1-[[(2S)-4-methyl-1-[[(3S)-5-methyl-2-oxohexan-3-yl]amino]-1-oxopentan-2-yl]amino]-1-oxopentan-2-yl]carbamic acid (phenylmethyl) ester (CHEBI:95288) is a peptide (CHEBI:16670)
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