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grixazone A

Properties

Image

Occurences in reactions

MNX_ID

MNXM114513

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

formula

C₁₈H₁₄N₃O₆S

charge

-1

mass

400.385

reference

chebi:73482

InChIKey

CBXHEDPBKOZZSI-NSHDSACASA-M

InChI

InChI=1S/C18H15N3O6S/c1-8(23)20-11(18(25)26)7-28-17-15(19)12(24)5-14-16(17)21-10-4-9(6-22)2-3-13(10)27-14/h2-6,11H,7,19H2,1H3,(H,20,23)(H,25,26)/p-1/t11-/m0/s1

SMILES

[CH3:1][C:8](=[N:20][C@@H:11]([CH2:7][S:28][c:17]1[c:15]([NH2:19])[c:12](=[O:24])[cH:5][c:14]2[o:27][c:13]3[cH:3][cH:2][c:9]([CH:6]=[O:22])[cH:4][c:10]3[n:21][c:16]1-2)[C:18](=[O:25])[OH:26])[OH:23]

Parent-child relations graph

Deprecated MNXref IDs graph

Similar chemical compounds in external resources
Identifier	Description
CHEBI:73482 chebi:73482	grixazone A (2R)-2-acetamido-3-[(2-amino-8-formyl-3-oxo-3H-phenoxazin-1-yl)sulfanyl]propanoate grixazone A anion grixazone A(1-)
seed.compound:cpd33480 seedM:cpd33480	1-[[2-(acetylamino)-2-carboxyethyl]thio]-2-amino-3-oxo-8-formyl-3H-phenoxiazine grixazone A
metacyc.compound:CPD-14874 metacycM:CPD-14874	grixazone A 1-[[2-(acetylamino)-2-carboxyethyl]thio]-2-amino-3-oxo-8-formyl-3H-phenoxiazine
CHEBI:73546 chebi:73546	grixazone A N-acetyl-S-(2-amino-8-formyl-3-oxo-3H-phenoxazin-1-yl)-L-cysteine
seedM:M_cpd33480	secondary/obsolete/fantasy identifier