Chem
J-GLOBAL ID：200907083027943317   Nikkaji number：J39.141G

Ceforanide

セホラニド
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： C20H21N7O6S2
Molecular formula furigana： C20-H21-N7-O6-S2
Molecular weight： 519.549
InChI： InChI=1S/C20H21N7O6S2/c21-6-11-4-2-1-3-10(11)5-13(28)22-15-17(31)27-16(19(32)33)12(8-34-18(15)27)9-35-20-23-24-25-26(20)7-14(29)30/h1-4,15,18H,5-9,21H2,(H,22,28)(H,29,30)(H,32,33)/t15-,18-/m1/s1
InChI key： SLAYUXIURFNXPG-CRAIPNDOSA-N
SMILES： NCc1ccccc1CC(=O)N[C@H]1[C@H]2SCC(=C(N2C1=O)C(=O)O)CSc1nnnn1CC(=O)O
Systematic name  (3)：
  • (6R,7R)-7α-[[(2-アミノメチルフェニル)アセチル]アミノ]-3-[[[1-(カルボキシメチル)-1H-テトラゾール-5-イル]チオ]メチル]-8-オキソ-5-チア-1-アザビシクロ[4.2.0]オクタ-2-エン-2-カルボン酸
  • (6R,7R)-7-{2-[2-(アミノメチル)フェニル]アセトアミド}-3-({[1-(カルボキシメチル)-1H-1,2,3,4-テトラゾール-5-イル]スルファニル}メチル)-8-オキソ-5-チア-1-アザビシクロ[4.2.0]オクタ-2-エン-2-カルボン酸
  • (6R,7R)-7-{2-[2-(aminomethyl)phenyl]acetamido}-3-({[1-(carboxymethyl)-1H-1,2,3,4-tetrazol-5-yl]sulfanyl}methyl)-8-oxo-5-thia-1-azabicyclo[4.2.0]oct-2-ene-2-carboxylic acid
Other name (7)：
  • セホラニド
  • BL-S-786
  • Ceforanide
  • 抗生物質BL-S-786
  • Antibiotic BL-S-786
Show all
CAS registry number： 60925-61-3
KEGG DRUG： D00259
KEGG COMPOUND： C06884
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