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CHEBI:210962 - Phomarosine B

ChEBI IDCHEBI:210962
ChEBI NamePhomarosine B
Stars
SubmitterMetaboLights
DownloadsMolfile
FormulaC16H19NO7
Net Charge0
Average Mass337.328
Monoisotopic Mass337.11615
SMILESCOC(=O)[C@](NC(=O)C(=O)C(C)C)(OC)C(=O)c1ccc(O)cc1
InChIInChI=1S/C16H19NO7/c1-9(2)12(19)14(21)17-16(24-4,15(22)23-3)13(20)10-5-7-11(18)8-6-10/h5-9,18H,1-4H3,(H,17,21)/t16-/m1/s1
InChIKeyIDXJRCWPTXBTKD-MRXNPFEDSA-N
Species of MetaboliteComponentSourceComments
Phoma (ncbitaxon:37463) - DOI (10.1016/j.tet.2017.06.025)
Roles Classification
Chemical Role:
Bronsted acid  A molecular entity capable of donating a hydron to an acceptor (Brønsted base).
ChEBI Ontology
Outgoing Relation(s)
Phomarosine B (CHEBI:210962) is a N-acyl-amino acid (CHEBI:51569)
IUPAC Name 
methyl (2R)-3-(4-hydroxyphenyl)-2-methoxy-2-[(3-methyl-2-oxobutanoyl)amino]-3-oxopropanoate
Manual XrefsDatabases
78439173ChemSpider