Chemical Component Summary | |
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Name | (2S,3R)-4-(2-aminoethylcarbamoyloxy)-2-[(2-methanoylindolizin-3-yl)amino]-3-methyl-3-sulfino-butanoic acid |
Synonyms | penam sulfone SA3-53, open form |
Identifiers | (2S,3R)-4-(2-azanylethylcarbamoyloxy)-2-[(2-methanoylindolizin-3-yl)amino]-3-methyl-3-[(R)-oxidanylsulfinyl]butanoic acid |
Formula | C17 H22 N4 O7 S |
Molecular Weight | 426.444 |
Type | NON-POLYMER |
Isomeric SMILES | C[C@](COC(=O)NCCN)([C@H](C(=O)O)Nc1c(cc2n1cccc2)C=O)[S@](=O)O |
InChI | InChI=1S/C17H22N4O7S/c1-17(29(26)27,10-28-16(25)19-6-5-18)13(15(23)24)20-14-11(9-22)8-12-4-2-3-7-21(12)14/h2-4,7-9,13,20H,5-6,10,18H2,1H3,(H,19,25)(H,23,24)(H,26,27)/t13-,17-/m0/s1 |
InChIKey | UGXGYKKZKHIUJW-GUYCJALGSA-N |
Chemical Details | |
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Formal Charge | 0 |
Atom Count | 51 |
Chiral Atom Count | 2 |
Bond Count | 52 |
Aromatic Bond Count | 10 |
Related Resource References
Resource Name | Reference |
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PubChem | 49867347 |