aspoxicillin

Molecular Formula: C21H27N5O7S


InChI: InChI=1/C21H27N5O7S/c1-21(2)15(20(32)33)26-18(31)14(19(26)34-21)25-17(30)13(9-4-6-10(27)7-5-9)24-16(29)11(22)8-12(28)23-3/h4-7,11,13-15,19,27H,8,22H2,1-3H3,(H,23,28)(H,24,29)(H,25,30)(H,32,33)/t11-,13-,14-,15+,19-/m1/s1/f/h23-25,32H

InChIKey: InChIKey=BHELIUBJHYAEDK-ISCXYKRYDB
SMILES: CC1(C(N2C(S1)C(C2=O)NC(=O)C(C3=CC=C(C=C3)O)NC(=O)C(CC(=O)NC)N)C(=O)O)C

Names:
    Aspoxicilina [Spanish]
    Aspoxicillan
    Aspoxicilline [French]
    Aspoxicillinum [Latin]
    Aspoxicillin [INN:JAN]
    aspoxicillin
    CCRIS 2514
    N(sup 4)-Methyl-D-asparagininylamoxicillin
    TA 058
    (2R,5R,6S)-6-[[(2R)-2-[[(2R)-2-amino-3-(methylcarbamoyl)propanoyl]amino]-2-(4-hydroxyphenyl)acetyl]amino]-3,3-dimethyl-7-oxo-4-thia-1-azabicyclo[3.2.0]heptane-2-carboxylic acid
    63358-49-6

Registries:
    PubChem CID 71961
    PubChem ID 214228