CHEBI:3147 - Boc-Asn-OPhNO2

Main ChEBI Ontology Automatic Xrefs Reactions Pathways Models
ChEBI Name Boc-Asn-OPhNO2
ChEBI ID CHEBI:3147
Stars This entity has been manually annotated by a third party.
Supplier Information
Download Molfile XML SDF
Formulae C15H19N3O7
C15H19N3O7
Net Charge 0
Average Mass 353.328
Monoisotopic Mass 353.12230
InChI InChI=1S/C15H19N3O7/c1-15(2,3)25-14(21)17-11(8-12(16)19)13(20)24-10-6-4-9(5-7-10)18(22)23/h4-7,11H,8H2,1-3H3,(H2,16,19)(H,17,21)/t11-/m0/s1
InChIKey IAPXDJMULQXGDD-NSHDSACASA-N
SMILES C=1(C=CC([N+](=O)[O-])=CC1)OC([C@@H](NC(OC(C)(C)C)=O)CC(N)=O)=O
ChEBI Ontology
Outgoing Boc-Asn-OPhNO2 (CHEBI:3147) has functional parent 4-nitrophenol (CHEBI:16836)
Boc-Asn-OPhNO2 (CHEBI:3147) is a C-nitro compound (CHEBI:35716)
Boc-Asn-OPhNO2 (CHEBI:3147) is a L-asparagine derivative (CHEBI:52987)
Boc-Asn-OPhNO2 (CHEBI:3147) is a carbamate ester (CHEBI:23003)
Boc-Asn-OPhNO2 (CHEBI:3147) is a primary carboxamide (CHEBI:140324)
Synonym Source
Boc-Asn-OPhNO2 KEGG COMPOUND
Manual Xref Database
C02138 KEGG COMPOUND
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Last Modified
13 March 2018