epicillin - Moligand™ , CAS No.26774-90-3

CAS: 26774-90-3 Cat. No.: E610157 PubChem CID: 71392
Disponible para pedir
GRADE & PURITY Moligand™ ? Moligand™ — Aladdin's line of ligands and bioactive small molecules. Use for receptor, pathway, and binding studies needing defined small-molecule tools.
Synonyms
Epicilina [INN-Spanish] | DB13300 | Epicillin | Epicilline [INN-French] | RPBAFSBGYDKNRG-NJBDSQKTSA-N | SQ-11302 | Dihydroampicillin | CHEBI:58974 | D04020 | 3,4,5-trimethoxy-N-(piperidin-3-yl)benzamide | 6-((Amino-1,4-cyclohexadien-1-ylacetyl)amino)-3,3-
Storage
Room temperature
 ·  off list, applied to all prices below.
Size
Estado
Price
Qty
5mg
E610157-5mg
8-12 wks(?) Production requires sourcing of materials. We appreciate your patience and understanding.
799,90US$
25mg
E610157-25mg
8-12 wks(?) Production requires sourcing of materials. We appreciate your patience and understanding.
1.714,90US$
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Why this grade

Moligand™ Moligand™ for sensitive chromatographic and analytical workflows requiring minimal baseline interference.

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Storage & shipping

Room temperature Ships Check lot-specific COA for exact specifications.

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Quality documents

SDS, COA, datasheet, and spec sheet available for download. Lot-specific COA accessible via lot number lookup.

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Literature proof

Cited in 0 peer-reviewed publications across chromatography, organic synthesis, and cross-coupling reactions.

Specifications

Sinónimos
Epicilina [INN-Spanish] | DB13300 | Epicillin | Epicilline [INN-French] | RPBAFSBGYDKNRG-NJBDSQKTSA-N | SQ-11302 | Dihydroampicillin | CHEBI:58974 | D04020 | 3, 4, 5-trimethoxy-N-(piperidin-3-yl)benzamide | 6-((Amino-1, 4-cyclohexadien-1-ylacetyl)amino)-3, 3-
Especificaciones y pureza
Moligand™
Condiciones de almacenamiento de almacenamiento
Room temperature
Grado
Moligand™
Nombres e identificadores
Sonrisas canónicasN[C@H](C1=CCC=CC1)C(=O)N[C@@H]1C(=O)N2[C@@H]1SC([C@@H]2C(=O)O)(C)C
IUPAC Name(2S,5R,6R)-6-[[(2R)-2-amino-2-cyclohexa-1,4-dien-1-ylacetyl]amino]-3,3-dimethyl-7-oxo-4-thia-1-azabicyclo[3.2.0]heptane-2-carboxylic acid
InChIKeyRPBAFSBGYDKNRG-NJBDSQKTSA-N
INCHI1S/C16H21N3O4S/c1-16(2)11(15(22)23)19-13(21)10(14(19)24-16)18-12(20)9(17)8-6-4-3-5-7-8/h3-4,7,9-11,14H,5-6,17H2,1-2H3,(H,18,20)(H,22,23)/t9-,10-,11+,14-/m1/s1
Isómeros SMILES CC1([C@@H](N2[C@H](S1)[C@@H](C2=O)NC(=O)[C@@H](C3=CCC=CC3)N)C(=O)O)C
PubChem CID 71392

Documentation

📋 Safety Data Sheet (SDS)

Comprehensive hazard, handling, storage, and regulatory compliance document.

Download SDS →

✅ Certificate of Analysis (COA)

Lot-specific quality data. Enter your lot number to retrieve the exact COA.

Look up COA →

📊 Datasheet

Quick-reference summary of product specifications and applications.

View datasheet →

🔬 Specification Sheet

Full quality attributes and acceptance criteria for this grade.

View spec sheet →

Advanced Data

Taxonomic Classification

Taxonomy Tree

KingdomOrganic compounds
SuperclassOrganoheterocyclic compounds
ClaseLactams
SubclassBeta lactams
Intermediate Tree Nodes Penams
Direct ParentPenicillins
Alternative Parents N-acyl-alpha amino acids and derivatives  Alpha amino acid amides  Thiazolidines  Tertiary carboxylic acid amides  Secondary carboxylic acid amides  Amino acids  Azetidines  Thiohemiaminal derivatives  Monocarboxylic acids and derivatives  Azacyclic compounds  Dialkylthioethers  Carboxylic acids  Carbonyl compounds  Hydrocarbon derivatives  Monoalkylamines  Organic oxides  Organopnictogen compounds  
Molecular FrameworkAliphatic heteropolycyclic compounds
Substituents Penicillin - N-acyl-alpha amino acid or derivatives - Alpha-amino acid amide - Alpha-amino acid or derivatives - Tertiary carboxylic acid amide - Thiazolidine - Amino acid or derivatives - Azetidine - Carboxamide group - Secondary carboxylic acid amide - Amino acid - Azacycle - Dialkylthioether - Hemithioaminal - Thioether - Carboxylic acid derivative - Carboxylic acid - Monocarboxylic acid or derivatives - Amine - Organopnictogen compound - Primary aliphatic amine - Organonitrogen compound - Organooxygen compound - Organic oxygen compound - Carbonyl group - Organic nitrogen compound - Hydrocarbon derivative - Organic oxide - Primary amine - Aliphatic heteropolycyclic compound
DescripciónThis compound belongs to the class of organic compounds known as penicillins. These are organic compounds containing the penicillin core structure, which is structurally characterized by a penam ring bearing two methyl groups at position 2, and an amide group at position 6 [starting from the sulfur atom at position 1].
External Descriptors penicillin
Estructura 3D
Modelo de Estructura Química Interactiva





Certificados (CoA, COO, BSE/TSE y tabla de análisis)
C of A & Other Certificates(BSE/TSE, COO):
Analytical Chart:
Propiedades químicas y físicas
Peso molecular351.400 g/mol
XLogP3-1.300
Hydrogen Bond Donor Count3
Hydrogen Bond Acceptor Count6
Rotatable Bond Count4
Exact Mass351.125 Da
Monoisotopic Mass351.125 Da
Topological Polar Surface Area138.000 Ų
Heavy Atom Count24
Formal Charge0
Complexity658.000
Isotope Atom Count0
Defined Atom Stereocenter Count4
Undefined Atom Stereocenter Count0
Defined Bond Stereocenter Count0
Undefined Bond Stereocenter Count0
The total count of all stereochemical bonds0
Covalently-Bonded Unit Count1
Calculadoras de soluciones
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