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methicillin

Properties

Image

Occurences in reactions

MNX_ID

MNXM157859

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

formula

C₁₇H₂₀N₂O₆S

charge

mass

380.10421

reference

chebi:6827

InChIKey

RJQXTJLFIWVMTO-TYNCELHUSA-N

InChI

InChI=1S/C17H20N2O6S/c1-17(2)12(16(22)23)19-14(21)11(15(19)26-17)18-13(20)10-8(24-3)6-5-7-9(10)25-4/h5-7,11-12,15H,1-4H3,(H,18,20)(H,22,23)/t11-,12+,15-/m1/s1

SMILES

COc1cccc(OC)c1C(=O)N[C@@H]1C(=O)N2[C@@H](C(=O)O)C(C)(C)S[C@H]12

Parent-child relations graph

Deprecated MNXref IDs graph

Similar chemical compounds in external resources
Identifier	Description
CHEBI:6827 chebi:6827	methicillin (2S,5R,6R)-6-[(2,6-dimethoxybenzoyl)amino]-3,3-dimethyl-7-oxo-4-thia-1-azabicyclo[3.2.0]heptane-2-carboxylic acid 6beta-(2,6-dimethoxybenzamido)-2,2-dimethylpenam-3alpha-carboxylic acid 6beta-(2,6-dimethoxybenzamido)penicillanic acid Methicillin meticilina meticillin meticilline meticillinum
sabiork.compound:23691 sabiorkM:23691 kegg.compound:C07177 keggC:C07177	Methicillin
seed.compound:cpd04426 seedM:cpd04426	Methicillin Dimocillin Metacillin Methicillinum Methycillin methicillin
hmdb:HMDB0015541	Meticillin (2,6-Dimethoxyphenyl)penicillin (2S,5R,6R)-6-(2,6-dimethoxybenzamido)-3,3-dimethyl-7-oxo-4-thia-1-azabicyclo[3.2.0]heptane-2-carboxylic acid (2S,5R,6R)-6-[(2,6-Dimethoxybenzoyl)amino]-3,3-dimethyl-7-oxo-4-thia-1-azabicyclo[3.2.0]heptane-2-carboxylate (2S,5R,6R)-6-[(2,6-Dimethoxybenzoyl)amino]-3,3-dimethyl-7-oxo-4-thia-1-azabicyclo[3.2.0]heptane-2-carboxylic acid 6-(2,6-Dimethoxybenzamido)penicillanic acid 6b-(2,6-Dimethoxybenzamido)penicillanate 6b-(2,6-Dimethoxybenzamido)penicillanic acid 6beta-(2,6-Dimethoxybenzamido)penicillanate 6beta-(2,6-Dimethoxybenzamido)penicillanic acid 6beta-(2,6-dimethoxybenzamido)penicillanate 6beta-(2,6-dimethoxybenzamido)penicillanic acid CSL Brand OF methicillin sodium Dimethoxyphenyl penicillin Methicillin hydrate, monosodium salt Methicillin monohydrate, monosodium salt Methicillin sodium Methicillinum Methycillin Meticilina Meticilline Meticillinum Metin Penicillin, dimethoxyphenyl Staphcillin methicillin
CHEBI:52064 chebi:52064	methicillin(1-) (2S,5R,6R)-6-[(2,6-dimethoxybenzoyl)amino]-3,3-dimethyl-7-oxo-4-thia-1-azabicyclo[3.2.0]heptane-2-carboxylate 6beta-(2,6-dimethoxybenzamido)-2,2-dimethylpenam-3alpha-carboxylate 6beta-(2,6-dimethoxybenzamido)penicillanate
metacyc.compound:CPD-9220 metacycM:CPD-9220	methicillin Dimocillin Metacillin Methicillinum Methycillin
hmdb:HMDB15541 keggC:M_C07177 seedM:M_cpd04426	secondary/obsolete/fantasy identifier