CHEBI:217611 - (2S)-1-[(2S)-2-[[(2S)-5-amino-2-[[(2S)-2-amino-3-(4-hydroxyphenyl)propanoyl]amino]-5-oxopentanoyl]amino]-4-methylpentanoyl]pyrrolidine-2-carboxylic acid

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ChEBI Name (2S)-1-[(2S)-2-[[(2S)-5-amino-2-[[(2S)-2-amino-3-(4-hydroxyphenyl)propanoyl]amino]-5-oxopentanoyl]amino]-4-methylpentanoyl]pyrrolidine-2-carboxylic acid
ChEBI ID CHEBI:217611
Stars This entity has been manually annotated by a third party.
Submitter MetaboLights
Supplier Information
Download Molfile XML SDF
Formula C25H37N5O7
Net Charge 0
Average Mass 519.599
Monoisotopic Mass 519.26930
InChI InChI=1S/C25H37N5O7/c1-14(2)12-19(24(35)30-11-3-4-20(30)25(36)37)29-23(34)18(9-10-21(27)32)28-22(33)17(26)13-15-5-7-16(31)8-6-15/h5-8,14,17-20,31H,3-4,9-13,26H2,1-2H3,(H2,27,32)(H,28,33)(H,29,34)(H,36,37)/t17-,18-,19-,20-/m0/s1
InChIKey ZODVQAQTYNSMAA-MUGJNUQGSA-N
SMILES O=C(O)[C@H]1N(C(=O)[C@@H](NC(=O)[C@@H](NC(=O)[C@@H](N)CC2=CC=C(O)C=C2)CCC(=O)N)CC(C)C)CCC1
Metabolite of Species Details
Penicillium citrinum (NCBI:txid5077) See: PubMed
Roles Classification
Chemical Role(s): Bronsted base
A molecular entity capable of accepting a hydron from a donor (Bronsted acid).
(via organic amino compound )
View more via ChEBI Ontology
ChEBI Ontology
Outgoing (2S)-1-[(2S)-2-[[(2S)-5-amino-2-[[(2S)-2-amino-3-(4-hydroxyphenyl)propanoyl]amino]-5-oxopentanoyl]amino]-4-methylpentanoyl]pyrrolidine-2-carboxylic acid (CHEBI:217611) is a oligopeptide (CHEBI:25676)
IUPAC Name
(2S)-1-[(2S)-2-[[(2S)-5-amino-2-[[(2S)-2-amino-3-(4-hydroxyphenyl)propanoyl]amino]-5-oxopentanoyl]amino]-4-methylpentanoyl]pyrrolidine-2-carboxylic acid
Manual Xref Database
71044323 ChemSpider
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