Carumonam Sodium
Basic information
- CAS
86832-68-0- Standard SMILES
NC(=O)OC[C@@H]1[C@H](NC(=O)/C(=N\OCC(=O)[O-])c2csc(N)n2)C(=O)N1S(=O)(=O)[O-].[Na+].[Na+]- InChIKey
BGGXRVPCJUKHTQ-AHCAJXDVSA-L- Molecular formula
- C12H12N6Na2O10S2
- Average molar mass
- 510.4 g/mol
- Monoisotopic mass
- 509.98517151
Overview
Carumonam sodium is the disodium salt of carumonam. It contains a carumonam(1-).
Names & identifiers
- Preferred name
- Carumonam Sodium
- IUPAC
- disodium;2-[(Z)-[1-(2-amino-1,3-thiazol-4-yl)-2-[[(2S,3S)-2-(carbamoyloxymethyl)-4-oxo-1-sulfonatoazetidin-3-yl]amino]-2-oxoethylidene]amino]oxyacetate
- English name
- (+)-[[(2Z)-[2-[[(2S 3s)-2-[[(aminocarbon
- Molecular formula
- C12H12N6O10S2.2Na
- Molecular weight
- 510.371
Names & synonyms
carumonam sodiumCarumonam disodium salt86832-68-0AmasulinCarumonam sodium [USAN:JAN]Ro 17-2301/006DTXSID1046712Amasulin (TN)B4J4M4939DAMA 1080(2NA)Ro-17-2301/006CARUMONAM SODIUM [JAN]
Show more names
MobactamcarumonamsodiumCarlumonan sodiumCarumonam disodium3-alpha(z)))--(2-alphCarumonam disodium salt 97%CARUMONAM SODIUM 86832-68-0(+)-(Z)-(((1-(AMINO-4-THIAZOLYL)-2-(((2&
Ro-172301006CARUMONAM SODIUM [USAN]DTXCID9026712CHEBI:31363CARUMONAM SODIUM [MART.]CARUMONAM SODIUM [WHO-DD]CARUMONAM DISODIUM SALT [MI](Z)-((((2-Amino-4-thiazolyl)(((2S,3S)-2-(hydroxymethyl)-4-oxo-1-sulfo-3-azetidinyl)carbamoyl)methylene)amino)oxy)acetic acid, carbamate (ester), disodium salt
Database identifiers
- CAS
Properties
Computed structural properties
- Topological polar surface area
- 296 Ų
- Hydrogen bond donors
- 3
- Hydrogen bond acceptors
- 14
- Rotatable bonds
- 8
- Heavy atoms
- 32
- Formal charge
- 0
- Complexity
- 839
Physicochemical properties
- Melting point
- 250 °C · 250 °C (dec.)(lit.)
- optical activity
- 20 · [α]20/D +18°, c = 1% in H2O
- FDA UNII
- 4 J4M4939D · B4J4M4939D
- Symbol(GHS)
- 7 · GHS07
- Signal word
- Warning
- Hazard statements
- 315 · H315-H319-H335
- Precautionary statements
- 261 · P261-P305+P351+P338
- Hazard Codes
- Xi
- Risk Statements
- 36 · 36/37/38
- Safety Statements
- 26 · 26-36
- WGK Germany
- 2 · 2
- RTECS
- 2450000 · AF2450000
Safety & regulation
Safety information is for reference only and does not replace the supplier’s Safety Data Sheet (SDS), applicable regulations, or professional assessment.
GHS classification
GHS Classification
Warning
H315 (100%): Causes skin irritation [Warning Skin corrosion/irritation]
P261, P264, P264+P265, P271, P280, P302+P352, P304+P340, P305+P351+P338, P319, P321, P332+P317, P337+P317, P362+P364, P403+P233, P405, and P501 (click each P-code to see the statement)
Aggregated GHS information provided per 39 reports by companies from 2 notifications to the ECHA C&L Inventory. Each notification may be associated with multiple companies.
Hazard information
Hazard Classes and CategoriesSkin Irrit. 2 (100%)
Safety data
- wgk
- 2
- rtecs
- AF2450000
- risk_code
- 36/37/38
- Signal word
- Warning
- Symbol(GHS)
- GHS07
- hazard_code
- Xi
- safety_code
- 26-36
- Hazard statements
- H315-H319-H335
- Precautionary statements
- P261-P305+P351+P338
Chemistry & industry
Applications
UsesCarumonam Disodium Salt is a monobactam antibiotic.
Additional notes
DefinitionChEBI: The disodium salt of carumonam.
Related reactions
0 records
No reaction records under the current filter.
Compound notes
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