Chemical Component Summary | |
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Name | (2S,3R)-2-[(7-aminocarbonyl-2-methanoyl-indolizin-3-yl)amino]-4-aminocarbonyloxy-3-methyl-3-sulfino-butanoic acid |
Identifiers | (2S,3R)-2-[(7-aminocarbonyl-2-methanoyl-indolizin-3-yl)amino]-4-aminocarbonyloxy-3-methyl-3-sulfino-butanoic acid |
Formula | C16 H18 N4 O8 S |
Molecular Weight | 426.401 |
Type | NON-POLYMER |
Isomeric SMILES | C[C@](COC(=O)N)([C@H](C(=O)O)Nc1c(cc2n1ccc(c2)C(=O)N)C=O)[S@](=O)O |
InChI | InChI=1S/C16H18N4O8S/c1-16(29(26)27,7-28-15(18)25)11(14(23)24)19-13-9(6-21)5-10-4-8(12(17)22)2-3-20(10)13/h2-6,11,19H,7H2,1H3,(H2,17,22)(H2,18,25)(H,23,24)(H,26,27)/t11-,16-/m0/s1 |
InChIKey | WVRCRSIVCWLCEG-ZBEGNZNMSA-N |
Chemical Details | |
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Formal Charge | 0 |
Atom Count | 47 |
Chiral Atom Count | 3 |
Bond Count | 48 |
Aromatic Bond Count | 10 |
Related Resource References
Resource Name | Reference |
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PubChem | 49867346 |