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Details

Stereochemistry ABSOLUTE
Molecular Formula C22H21N4O7S.Na
Molecular Weight 508.48
Optical Activity ( + )
Defined Stereocenters 4 / 4
E/Z Centers 0
Charge 0

SHOW SMILES / InChI
Structure of FURBENCILLIN SODIUM

SMILES

[Na+].CC1(C)S[C@@H]2[C@H](NC(=O)[C@H](NC(=O)NC(=O)C3=CC=CO3)C4=CC=CC=C4)C(=O)N2[C@H]1C([O-])=O

InChI

InChIKey=YOTPFEANWNMKOO-AVIAQYPTSA-M
InChI=1S/C22H22N4O7S.Na/c1-22(2)15(20(30)31)26-18(29)14(19(26)34-22)23-17(28)13(11-7-4-3-5-8-11)24-21(32)25-16(27)12-9-6-10-33-12;/h3-10,13-15,19H,1-2H3,(H,23,28)(H,30,31)(H2,24,25,27,32);/q;+1/p-1/t13-,14-,15+,19-;/m1./s1

HIDE SMILES / InChI

Molecular Formula C22H21N4O7S
Molecular Weight 485.49
Charge -1
Count
Stereochemistry ABSOLUTE
Additional Stereochemistry No
Defined Stereocenters 4 / 4
E/Z Centers 0
Optical Activity UNSPECIFIED

Molecular Formula Na
Molecular Weight 22.98976928
Charge 1
Count
Stereochemistry ACHIRAL
Additional Stereochemistry No
Defined Stereocenters 0 / 0
E/Z Centers 0
Optical Activity NONE

Approval Year

Substance Class Chemical
Created
by admin
on Wed Apr 02 10:13:22 GMT 2025
Edited
by admin
on Wed Apr 02 10:13:22 GMT 2025
Record UNII
V2YUD64EH7
Record Status Validated (UNII)
Record Version
  • Download
Name Type Language
FURBENCILLIN SODIUM
Common Name English
4-THIA-1-AZABICYCLO(3.2.0)HEPTANE-2-CARBOXYLIC ACID, 6-((((((2-FURANYLCARBONYL)AMINO)CARBONYL)AMINO)PHENYLACETYL)AMINO)-3,3-DIMETHYL-7-OXO-, MONOSODIUM SALT, (2S-(2.ALPHA.,5.ALPHA.,6.BETA.(S*)))-
Preferred Name English
4-THIA-1-AZABICYCLO(3.2.0)HEPTANE-2-CARBOXYLIC ACID, 6-(((2R)-((((2-FURANYLCARBONYL)AMINO)CARBONYL)AMINO)PHENYLACETYL)AMINO)-3,3-DIMETHYL-7-OXO-, MONOSODIUM SALT, (2S,5R,6R)-
Common Name English
4-THIA-1-AZABICYCLO(3.2.0)HEPTANE-2-CARBOXYLIC ACID, 6-(2-(3-(2-FUROYL)UREIDO)-2-PHENYLACETAMIDO)-3,3-DIMETHYL-7-OXO-, MONOSODIUM SALT, D-
Systematic Name English
4-THIA-1-AZABICYCLO(3.2.0)HEPTANE-2-CARBOXYLIC ACID, 6-(((2R)-2-((((2-FURANYLCARBONYL)AMINO)CARBONYL)AMINO)-2-PHENYLACETYL)AMINO)-3,3-DIMETHYL-7-OXO-, SODIUM SALT (1:1), (2S,5R,6R)-
Systematic Name English
Code System Code Type Description
FDA UNII
V2YUD64EH7
Created by admin on Wed Apr 02 10:13:22 GMT 2025 , Edited by admin on Wed Apr 02 10:13:22 GMT 2025
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CAS
25673-35-2
Created by admin on Wed Apr 02 10:13:22 GMT 2025 , Edited by admin on Wed Apr 02 10:13:22 GMT 2025
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SMS_ID
100000155459
Created by admin on Wed Apr 02 10:13:22 GMT 2025 , Edited by admin on Wed Apr 02 10:13:22 GMT 2025
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PUBCHEM
163203570
Created by admin on Wed Apr 02 10:13:22 GMT 2025 , Edited by admin on Wed Apr 02 10:13:22 GMT 2025
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