CHEBI:198528 - Pyloricidin D

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ChEBI Name Pyloricidin D
ChEBI ID CHEBI:198528
Stars This entity has been manually annotated by a third party.
Submitter MetaboLights
Supplier Information
Download Molfile XML SDF
Formula C15H22N2O7
Net Charge 0
Average Mass 342.348
Monoisotopic Mass 342.14270
InChI InChI=1S/C15H22N2O7/c16-9(7-18)12(21)13(22)14(23)15(24)17-10(6-11(19)20)8-4-2-1-3-5-8/h1-5,9-10,12-14,18,21-23H,6-7,16H2,(H,17,24)(H,19,20)/t9-,10-,12+,13+,14-/m1/s1
InChIKey GVOBXKQKXYPNTR-SJVBDLOYSA-N
SMILES O=C(N[C@@H](C1=CC=CC=C1)CC(=O)O)[C@H](O)[C@@H](O)[C@@H](O)[C@H](N)CO
Metabolite of Species Details
Bacillusspecies (in: firmicutes) (NCBI:txid1409) See: PubMed
Roles Classification
Chemical Role(s): Bronsted acid
A molecular entity capable of donating a hydron to an acceptor (Bronsted base).
(via oxoacid )
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ChEBI Ontology
Outgoing Pyloricidin D (CHEBI:198528) is a benzenes (CHEBI:22712)
Pyloricidin D (CHEBI:198528) is a monocarboxylic acid (CHEBI:25384)
IUPAC Name
(3R)-3-[[(2R,3S,4S,5R)-5-amino-2,3,4,6-tetrahydroxyhexanoyl]amino]-3-phenylpropanoic acid
Manual Xref Database
78436368 ChemSpider
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