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CHEBI:201872 - Bilaid B1

ChEBI IDCHEBI:201872
ChEBI NameBilaid B1
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FormulaC28H39N5O5
Net Charge0
Average Mass525.650
Monoisotopic Mass525.29512
SMILESCC(C)C(NC(=O)C(N)Cc1ccccc1)C(=O)NC(C(=O)NC(Cc1ccc(O)cc1)C(N)=O)C(C)C
InChIInChI=1S/C28H39N5O5/c1-16(2)23(27(37)31-22(25(30)35)15-19-10-12-20(34)13-11-19)33-28(38)24(17(3)4)32-26(36)21(29)14-18-8-6-5-7-9-18/h5-13,16-17,21-24,34H,14-15,29H2,1-4H3,(H2,30,35)(H,31,37)(H,32,36)(H,33,38)
InChIKeyHQBCNNUPUYWTKE-UHFFFAOYSA-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)
Bilaid B1 (CHEBI:201872) is a peptide (CHEBI:16670)
IUPAC Name 
(2R)-N-[(2S)-1-[[(2R)-1-amino-3-(4-hydroxyphenyl)-1-oxopropan-2-yl]amino]-3-methyl-1-oxobutan-2-yl]-2-[[(2S)-2-amino-3-phenylpropanoyl]amino]-3-methylbutanamide
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