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7beta-aminodeacetoxycephalosporanic acid

PropertiesImage
MNX_IDMNXM102208 Image of MNXM102208
referencechebi:64984
formulaC8H10N2O3S
global charge0
mol weight214.246
InChIKeyNVIAYEIXYQCDAN-CLZZGJSISA-N
InChIInChI=1S/C8H10N2O3S/c1-3-2-14-7-4(9)6(11)10(7)5(3)8(12)13/h4,7H,2,9H2,1H3,(H,12,13)/t4-,7-/m1/s1
SMILESCC1=C(C(=O)O)N2C(=O)[C@@H](N)[C@H]2SC1
MNX internals
InChI (mnx)InChI=1/C8H10N2O3S/c1-3-2-14-7-4(9)6(11)10(7)5(3)8(12)13/h4,7H,2,9H2,1H3,(H,12,13)/t4-,7-/m1/s1 Image of MNXM102208
SMILES (mnx)[CH3:1][C:3]1=[C:5]([C:8](=[O:12])[OH:13])[N:10]2[C:6](=[O:11])[C@@H:4]([NH2:9])[C@H:7]2[S:14][CH2:2]1
Parent-child relations graph
Occurences in reactions#reac
in my sandbox 0
in MNXref (generic)1
in models (compartimentalized) 0
Similar chemical compounds in external resources
IdentifierDescription

CHEBI:64984
chebi:64984
NVIAYEIXYQCDAN-CLZZGJSISA-N 		7beta-aminodeacetoxycephalosporanic acid
(6R,7R)-7-amino-3-methyl-8-oxo-5-thia-1-azabicyclo[4.2.0]oct-2-ene-2-carboxylic acid
3-methyl-7-amino-Delta(3)-cephem-4-carboxylic acid
3-methyl-7-aminoceph-3-em-4-carboxylic acid
3-methyl-7beta-amino-Delta(3)-cephem-4-carboxylic acid
3-methyl-7beta-aminoceph-3-em-4-carboxylic acid
7-ADCA
7-Aminodesacetoxycephalosporanic acid
7-amino-3-methyl-3-cephem-4-carboxylic acid
7-amino-3-methyl-Delta(3)-cephem-4-carboxylic acid
7-amino-3-methylceph-3-em-4-carboxylic acid
7-aminodeacetoxycephalosporanic acid
7beta-amino-3-methyl-3-cephem-4-carboxylic acid
7beta-amino-3-methyl-Delta(3)-cephem-4-carboxylic acid
7beta-amino-3-methylceph-3-em-4-carboxylic acid

sabiork.compound:24833
sabiorkM:24833
NVIAYEIXYQCDAN-CLZZGJSISA-N 		7-Aminodeacetoxy cephalosporanic acid