CPP-115 - Moligand™ , Inhibitor of 4-aminobutyrate aminotransferase, CAS No.640897-20-7, Inhibitor of 4-aminobutyrate aminotransferase

CAS: 640897-20-7 Cat. No.: C609587 PubChem CID: 9794014
주문 가능
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
Q27076910 | NSC793876 | NSC-793876 | 5TD9324Z2U | AKOS040748176 | CPP-115 free base | compound 12 [PMID 25616005] | (1S,3S)-3-Amino-4-(difluoromethylene)cyclopentanecarboxylic acid | (+)-(1S,4S)-4-Amino-3-(difluoromethylene)-1-cyclopentanecarboxylic acid
Storage
Room temperature
Size
USA
독일 (EU)*
Price
Qty
5mg
C609587-5mg
주문제작 · 8~12주
US$799.90
25mg
C609587-25mg
주문제작 · 8~12주
US$1,300.90
Enter a quantity for the sizes you want to add.
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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

동의어
Q27076910 | NSC793876 | NSC-793876 | 5TD9324Z2U | AKOS040748176 | CPP-115 free base | compound 12 [PMID 25616005] | (1S,3S)-3-Amino-4-(difluoromethylene)cyclopentanecarboxylic acid | (+)-(1S,4S)-4-Amino-3-(difluoromethylene)-1-cyclopentanecarboxylic acid
사양 및 순도
Moligand™
보관 조건
Room temperature
등급
Moligand™
작업 유형
INHIBITOR
작동 메커니즘
Inhibitor of 4-aminobutyrate aminotransferase
이름과 식별자
정식 스마일OC(=O)[C@H]1CC(=C(F)F)[C@H](C1)N
IUPAC Name(1S,3S)-3-amino-4-(difluoromethylidene)cyclopentane-1-carboxylic acid
InChIKeyCBSRETZPFOBWNG-UCORVYFPSA-N
INCHI1S/C7H9F2NO2/c8-6(9)4-1-3(7(11)12)2-5(4)10/h3,5H,1-2,10H2,(H,11,12)/t3-,5-/m0/s1
이성체 SMILES C1[C@H](CC(=C(F)F)[C@H]1N)C(=O)O
PubChem CID 9794014

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
SuperclassOrganic acids and derivatives
분류Carboxylic acids and derivatives
SubclassAmino acids, peptides, and analogues
Intermediate Tree Nodes Amino acids and derivatives
Direct ParentGamma amino acids and derivatives
Alternative Parents Ketene acetals  Amino acids  Vinyl fluorides  Monocarboxylic acids and derivatives  Fluoroalkenes  Carboxylic acids  Organofluorides  Organic oxides  Monoalkylamines  Hydrocarbon derivatives  Carbonyl compounds  
Molecular FrameworkAliphatic homomonocyclic compounds
Substituents Gamma amino acid or derivatives - Ketene acetal or derivatives - Amino acid - Carboxylic acid - Monocarboxylic acid or derivatives - Vinyl fluoride - Vinyl halide - Haloalkene - Fluoroalkene - Primary amine - Organooxygen compound - Organonitrogen compound - Organofluoride - Organohalogen compound - Amine - Primary aliphatic amine - Carbonyl group - Organic nitrogen compound - Organic oxygen compound - Hydrocarbon derivative - Organic oxide - Aliphatic homomonocyclic compound
설명This compound belongs to the class of organic compounds known as gamma amino acids and derivatives. These are amino acids having a (-NH2) group attached to the gamma carbon atom.
External Descriptors Not available
3D 구조
상호 작용 화학 구조 모델





관련 대상(인간)
ABAT Tclin 4-aminobutyrate aminotransferase, mitochondrial (1 Activities)
Activity TypeActivity Value -log(M)Mechanism of ActionActivity ReferencePublications (PubMed IDs)
ABAT Tclin Gamma-amino-N-butyrate transaminase (140 Activities)
Activity TypeRelationActivity valueUnitsAction TypeJournalPubMed IddoiAssay Aladdin ID
작용 메커니즘
인증서(CoA, COO, BSE/TSE 및 분석 차트)
C of A & Other Certificates(BSE/TSE, COO):
Analytical Chart:
화학 및 물리적 특성
분자량177.150 g/mol
XLogP3-2.700
Hydrogen Bond Donor Count2
Hydrogen Bond Acceptor Count5
Rotatable Bond Count1
Exact Mass177.06 Da
Monoisotopic Mass177.06 Da
Topological Polar Surface Area63.300 Ų
Heavy Atom Count12
Formal Charge0
Complexity236.000
Isotope Atom Count0
Defined Atom Stereocenter Count2
Undefined Atom Stereocenter Count0
Defined Bond Stereocenter Count0
Undefined Bond Stereocenter Count0
The total count of all stereochemical bonds0
Covalently-Bonded Unit Count1
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리뷰

고객 리뷰

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