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L-anticapsin

Properties

Image

Occurences in reactions

MNX_ID

MNXM145814

	#reac
in my sandbox	0
in MNXref (generic)	3
in models (compartimentalized)	2

formula

C₉H₁₃NO₄

charge

mass

199.08446

reference

InChIKey

KHVZXXWDPSCGEK-MGVQOFIGSA-N

InChI

InChI=1S/C9H13NO4/c10-5(9(12)13)3-4-1-2-6(11)8-7(4)14-8/h4-5,7-8H,1-3,10H2,(H,12,13)/t4-,5-,7+,8-/m0/s1

SMILES

[NH3+][C@@H](C[C@@H]1CCC(=O)[C@@H]2O[C@H]12)C(=O)[O-]

Parent-child relations graph

Deprecated MNXref IDs graph

Similar chemical compounds in external resources
Identifier	Description
CHEBI:84310 chebi:84310	L-anticapsin (2S)-2-azaniumyl-3-[(1R,2S,6R)-5-oxo-7-oxabicyclo[4.1.0]hept-2-yl]propanoate L-anticapsin zwitterion anticapsin zwitterion
seed.compound:cpd34396 seedM:cpd34396	3-[(1R,2S,6R)-5-oxo-7-oxabicyclo[4.1.0]hept-2-yl]-L-alanine L-anticapsin
kegg.compound:C20941 keggC:C20941	L-Anticapsin Anticapsin
metacyc.compound:CPD-17509 metacycM:CPD-17509	L-anticapsin 3-[(1R,2S,6R)-5-oxo-7-oxabicyclo[4.1.0]hept-2-yl]-L-alanine
CHEBI:85005 chebi:85005	anticapsin 3-[(1R,2S,6R)-5-oxo-7-oxabicyclo[4.1.0]hept-2-yl]-L-alanine NSC 177854
keggC:M_C20941 seedM:M_cpd34396	secondary/obsolete/fantasy identifier