CHEBI:223023 - Vanoxonin

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This entity has been annotated by a third party. If you would like more information added to this entry, please contact ChEBI via email or GitHub.
ChEBI Name Vanoxonin
ChEBI ID CHEBI:223023
Stars This entity has been manually annotated by a third party.
Submitter MetaboLights
Supplier Information
Download Molfile XML SDF
Formula C18H25N3O9
Net Charge 0
Average Mass 427.410
Monoisotopic Mass 427.15908
InChI InChI=1S/C18H25N3O9/c1-9(22)14(20-16(26)11-5-3-7-13(24)15(11)25)17(27)19-12(18(28)29)6-4-8-21(30)10(2)23/h3,5,7,9,12,14,22,24-25,30H,4,6,8H2,1-2H3,(H,19,27)(H,20,26)(H,28,29)/t9-,12+,14+/m1/s1
InChIKey KCWDMHXDGAWLOA-LQJRIPTKSA-N
SMILES O=C(N[C@H](C(=O)N[C@H](C(=O)O)CCCN(O)C(=O)C)[C@H](O)C)C1=C(O)C(O)=CC=C1
Metabolite of Species Details
Saccharopolyspora (NCBI:txid1835) 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 Vanoxonin (CHEBI:223023) is a dipeptide (CHEBI:46761)
IUPAC Name
(2S)-5-[acetyl(hydroxy)amino]-2-[[(2S,3R)-2-[(2,3-dihydroxybenzoyl)amino]-3-hydroxybutanoyl]amino]pentanoic acid
Manual Xref Database
143444 ChemSpider
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