Chem
J-GLOBAL ID:200907044293480416   Nikkaji number:J14.626I

Bacampicillin

バカンピシリン
Substance type:
Substance type
Substance type classified into 3 categories.
Decided structure: Substances with a clear structure
Undicided Structure: Substances with unknown or undetermined structure
Mixtures: Mixtures, racemic compounds, or compounds with relative structural arrangements
Decided structure
Molecular formula: C21H27N3O7S
Molecular formula furigana: C21-H27-N3-O7-S
Molecular weight: 465.520
InChI: InChI=1S/C21H27N3O7S/c1-5-29-20(28)31-11(2)30-19(27)15-21(3,4)32-18-14(17(26)24(15)18)23-16(25)13(22)12-9-7-6-8-10-12/h6-11,13-15,18H,5,22H2,1-4H3,(H,23,25)/t11?,13-,14-,15+,18-/m1/s1
InChI key: PFOLLRNADZZWEX-FFGRCDKISA-N
SMILES: CCOC(=O)OC(C)OC(=O)[C@@H]1N2[C@H](SC1(C)C)[C@H](NC(=O)[C@H](N)c1ccccc1)C2=O
Systematic name  (5):
  • (2S,5β)-6α-[[(R)-アミノフェニルアセチル]アミノ]-3,3-ジメチル-7-オキソ-4-チア-1-アザビシクロ[3.2.0]ヘプタン-2β-カルボン酸1-[(エトキシカルボニル)オキシ]エチル
  • (2S,5R,6R)-6-[[(2R)-2-アミノ-2-フェニルアセチル]アミノ]-3,3-ジメチル-7-オキソ-4-チア-1-アザビシクロ[3.2.0]ヘプタン-2-カルボン酸1-(エトキシカルボニルオキシ)エチル
  • 6α-[[(R)-2-アミノ-2-フェニルアセチル]アミノ]ペニシラン酸1-[(エトキシカルボニル)オキシ]エチル
  • 1-[(エトキシカルボニル)オキシ]エチル (2S,5R,6R)-6-[(2R)-2-アミノ-2-フェニルアセトアミド]-3,3-ジメチル-7-オキソ-4-チア-1-アザビシクロ[3.2.0]ヘプタン-2-カルボキシラート
  • 1-[(ethoxycarbonyl)oxy]ethyl (2S,5R,6R)-6-[(2R)-2-amino-2-phenylacetamido]-3,3-dimethyl-7-oxo-4-thia-1-azabicyclo[3.2.0]heptane-2-carboxylate
Other name (4):
  • バカンピシリン
  • Bacampicillin
  • (2S,5R,6R)-6-[[(2R)-2-Amino-2-phenylacetyl]amino]-3,3-dimethyl-7-oxo-4-thia-1-azabicyclo[3.2.0]heptane-2-carboxylic acid 1-(ethoxycarbonyloxy)ethyl ester
  • 6α-[[(R)-2-Amino-2-phenylacetyl]amino]penicillanic acid 1-[(ethoxycarbonyl)oxy]ethyl ester
CAS registry number: 50972-17-3
Regulation number (1):
  • 8-(7)-616
KEGG DRUG: D07487
KEGG COMPOUND: C08122
Application (2):
penicillins ,  antibacterial drug
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