Apalcillin sodium
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Product Description
Product
Apalcillin sodium
CAS
58795-03-2
Synonym
Na; Apalcillin sodium; C25-H23-N5-O6-S.Na; COMPONENT; EINECS 261-446-1; FDA UNII 3XQ12NYC0Q; Lumota; Molecular Formula Fragments C25-H23-N5-O6-S; Molecular Formulas ?Molecular Formulas C25-H22-N5-Na-O6-S; PC 904; Registry Numbers CAS Registry Number 58795-03-2; Sodium (2S,5R,6R)-6-((R)-2-(4-hydroxy-1,5-naphthyridine-3-carboxamido)-2-phenylacetamido)-3,3-dimethyl-7-oxo-4-thia-1-azabicyclo(3.2.0)heptane-2-carboxylate; Superlist Name Wy-44,417 sodium; System Generated Number 0058795032; Systematic Name 4-Thia-1-azabicyclo(3.2.0)heptane-2-carboxylic acid, 6-(((((4-hydroxy-1,5-naphthyridin-3-yl)carbonyl)amino)phenylacetyl)amino)-3,3-dimethyl-7-oxo-, monosodium salt, (2S-(2alpha,5alpha,6beta(S*)))-; UNII-3XQ12NYC0Q; (2S,5R,6R)-6-[[(R)-(4-Hydroxypyrido[3,2-b]pyridin-3-ylcarbonylamino)phenylacetyl]amino]-3,3-dimethyl-7-oxo-4-thia-1-azabicyclo[3.2.0]heptane-2-carboxylic acid sodium salt; 4-Thia-1-azabicyclo(3.2.0)heptane-2-carboxylic acid, 6-(((((4-hydroxy-1,5-naphthyridin-3-yl)carbonyl)amino)phenylacetyl)amino)-3,3-dimethyl-7-oxo-, monosodium salt, (2S-(2alpha,5alpha,6beta(S*)))-; 4-Thia-1-azabicyclo[3.2.0]heptane-2-carboxylic acid, 6-[[[[(4-hydroxy-1,5-naphthyridin-3-yl)carbonyl]amino]phenylacetyl]amino]-3,3-dimethyl-7-oxo-, monosodium salt, [2S-[2alpha,5alpha,6beta(S*)]]-; 6a-[[(R)-[[(4-Hydroxy-1,5-naphthyridin-3-yl)carbonyl]amino]phenylacetyl]amino]penicillanic acid sodium salt
Typical Product Specifications
Molecular weight
543.53
EINECS
261-446-1
SMILES
[Na+].CC1(C)S[C@@H]2[C@H](NC(=O)[C@H](NC(=O)c3cnc4cccnc4c3O)c5ccccc5)C(=O)N2[C@H]1C(=O)[O-]
InChI
DIGBQDMXLUJMHN-FSWJYKAZSA-M
InChIKey
1S/C25H23N5O6S.Na/c1-25(2)19(24(35)36)30-22(34)17(23(30)37-25)29-21(33)15(12-7-4-3-5-8-12)28-20(32)13-11-27-14-9-6-10-26-16(14)18(13)31;/h3-11,15,17,19,23H,1-2H3,(H,27,31)(H,28,32)(H,29,33)(H,35,36);/q;+1/p-1/t15-,17-,19+,23-;/m1./s1
Class
Apalcillin sodium
Product Description
Product
Apalcillin sodium
CAS
58795-03-2
Synonym
Na; Apalcillin sodium; C25-H23-N5-O6-S.Na; COMPONENT; EINECS 261-446-1; FDA UNII 3XQ12NYC0Q; Lumota; Molecular Formula Fragments C25-H23-N5-O6-S; Molecular Formulas ?Molecular Formulas C25-H22-N5-Na-O6-S; PC 904; Registry Numbers CAS Registry Number 58795-03-2; Sodium (2S,5R,6R)-6-((R)-2-(4-hydroxy-1,5-naphthyridine-3-carboxamido)-2-phenylacetamido)-3,3-dimethyl-7-oxo-4-thia-1-azabicyclo(3.2.0)heptane-2-carboxylate; Superlist Name Wy-44,417 sodium; System Generated Number 0058795032; Systematic Name 4-Thia-1-azabicyclo(3.2.0)heptane-2-carboxylic acid, 6-(((((4-hydroxy-1,5-naphthyridin-3-yl)carbonyl)amino)phenylacetyl)amino)-3,3-dimethyl-7-oxo-, monosodium salt, (2S-(2alpha,5alpha,6beta(S*)))-; UNII-3XQ12NYC0Q; (2S,5R,6R)-6-[[(R)-(4-Hydroxypyrido[3,2-b]pyridin-3-ylcarbonylamino)phenylacetyl]amino]-3,3-dimethyl-7-oxo-4-thia-1-azabicyclo[3.2.0]heptane-2-carboxylic acid sodium salt; 4-Thia-1-azabicyclo(3.2.0)heptane-2-carboxylic acid, 6-(((((4-hydroxy-1,5-naphthyridin-3-yl)carbonyl)amino)phenylacetyl)amino)-3,3-dimethyl-7-oxo-, monosodium salt, (2S-(2alpha,5alpha,6beta(S*)))-; 4-Thia-1-azabicyclo[3.2.0]heptane-2-carboxylic acid, 6-[[[[(4-hydroxy-1,5-naphthyridin-3-yl)carbonyl]amino]phenylacetyl]amino]-3,3-dimethyl-7-oxo-, monosodium salt, [2S-[2alpha,5alpha,6beta(S*)]]-; 6a-[[(R)-[[(4-Hydroxy-1,5-naphthyridin-3-yl)carbonyl]amino]phenylacetyl]amino]penicillanic acid sodium salt
Typical Product Specifications
Molecular weight
543.53
EINECS
261-446-1
SMILES
[Na+].CC1(C)S[C@@H]2[C@H](NC(=O)[C@H](NC(=O)c3cnc4cccnc4c3O)c5ccccc5)C(=O)N2[C@H]1C(=O)[O-]
InChI
DIGBQDMXLUJMHN-FSWJYKAZSA-M
InChIKey
1S/C25H23N5O6S.Na/c1-25(2)19(24(35)36)30-22(34)17(23(30)37-25)29-21(33)15(12-7-4-3-5-8-12)28-20(32)13-11-27-14-9-6-10-26-16(14)18(13)31;/h3-11,15,17,19,23H,1-2H3,(H,27,31)(H,28,32)(H,29,33)(H,35,36);/q;+1/p-1/t15-,17-,19+,23-;/m1./s1
Class
