MT-DADMe-ImmA - ≥99% , CAS No.653592-04-2

CAS: 653592-04-2 Cat. No.: M646863 분자식: C13H19N5OS 분자량: 293.39 PubChem CID: 656970
주문 가능
GRADE & PURITY ≥99%
Storage
Store at -20°C
Shipped In
Ice chest + Ice pads
★
Size
USA
독일 (EU)*
Price
Qty
1mg
M646863-1mg
주문제작 · 8~12주

US$72.90

US$109.90
저장 US$37.00 (33.67%)
5mg
M646863-5mg
주문제작 · 8~12주

US$163.90

US$245.90
저장 US$82.00 (33.35%)
10mg
M646863-10mg
주문제작 · 8~12주

US$281.90

US$422.90
저장 US$141.00 (33.34%)
25mg
M646863-25mg
주문제작 · 8~12주

US$479.90

US$719.90
저장 US$240.00 (33.34%)
50mg
M646863-50mg
주문제작 · 8~12주

US$718.90

US$1,078.90
저장 US$360.00 (33.37%)
100mg
M646863-100mg
주문제작 · 8~12주

US$1,078.90

US$1,618.90
저장 US$540.00 (33.36%)
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🧪
Why this grade

≥99% for sensitive chromatographic and analytical workflows requiring minimal baseline interference.

🌡

Storage & shipping

Store at -20°C Ships Ice chest + Ice pads Check lot-specific COA for exact specifications.

📋

Quality documents

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

📚

Literature proof

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

개요

MT-DADMe-ImmA is an inhibitor of human 5'-methylthioadenosine phosphorylase ( MTAP ) with a K i of 90 pM.

In Vitro

Treatment of cultured cells with MT-DADMe-ImmA and MTA inhibit MTAP, increase cellular MTA concentrations, decrease polyamines, and induce apoptosis in FaDu and Cal27, two head and neck squamous cell carcinoma cell lines. The same treatment does not induce apoptosis in normal human fibroblast cell lines (CRL2522 and GM02037) or in MCF7, a breast cancer cell line with an MTAP gene deletion. MT-DADMe-ImmA alone does not induce apoptosis in any cell line, implicating MTA as the active agent. MCE has not independently confirmed the accuracy of these methods. They are for reference only.

In Vivo

The t 1/2 for onset of inhibition is 50 min with complete inhibition by 250 min. MTAP activity slowly returns, giving a biological half-life for the action of oral MT-DADMe-ImmA of 6.3 days. The time-dependent growth of FaDu tumors in immunodeficient mice is suppressed by oral or intraperitoneal treatment with MT-DADMe-ImmA. MCE has not independently confirmed the accuracy of these methods. They are for reference only.

Cell Assay

Cell viability is evaluated using the Alamar Blue assay. Cells are seeded onto 96-well plates at a density of 104 cells/well and incubated with increasing concentrations of MT-DADMe-ImmA (100 pM to 100 μM) for 4 days at fixed MTA concentrations (0, 5, 10, and 20 μM). IC 50 is determined with the assay data. MCE has not independently confirmed the accuracy of these methods. They are for reference only.

Form:Solid

IC50& Target:Ki: 90 pM (MTAP)

Specifications

사양 및 순도
≥99%
생화학 및 생리적 메커니즘
MT-DADMe-ImmA is an inhibitor of human 5'-methylthioadenosine phosphorylase ( MTAP ) with a K i of 90 pM.
보관 조건
Store at -20°C
배송
Ice chest + Ice pads
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작업 유형
INHIBITOR
순수함
≥99%
이름과 식별자
정식 스마일
CSCC1CN(CC1O)CC2=CNC3=C2N=CN=C3N
IUPAC Name
(3R,4S)-1-[(4-amino-5H-pyrrolo[3,2-d]pyrimidin-7-yl)methyl]-4-(methylsulfanylmethyl)pyrrolidin-3-ol
InChIKey
NTHMDFGHOCNNOE-ZJUUUORDSA-N
INCHI
1S/C13H19N5OS/c1-20-6-9-4-18(5-10(9)19)3-8-2-15-12-11(8)16-7-17-13(12)14/h2,7,9-10,15,19H,3-6H2,1H3,(H2,14,16,17)/t9-,10+/m1/s1
이성체 SMILES
CSC[C@H]1CN(C[C@@H]1O)CC2=CNC3=C2N=CN=C3N
PubChem CID
656970
분자량
293.39

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
분류Pyrrolopyrimidines
SubclassNot available
Intermediate Tree Nodes Not available
Direct ParentPyrrolopyrimidines
Alternative Parents Aralkylamines  Aminopyrimidines and derivatives  Substituted pyrroles  N-alkylpyrrolidines  Imidolactams  Heteroaromatic compounds  Trialkylamines  Secondary alcohols  1,2-aminoalcohols  Sulfenyl compounds  Dialkylthioethers  Azacyclic compounds  Primary amines  Organopnictogen compounds  Hydrocarbon derivatives  
Molecular FrameworkAromatic heteropolycyclic compounds
Substituents Pyrrolopyrimidine - Aminopyrimidine - Aralkylamine - Pyrimidine - Substituted pyrrole - N-alkylpyrrolidine - Imidolactam - Heteroaromatic compound - Pyrrole - Pyrrolidine - 1,2-aminoalcohol - Tertiary aliphatic amine - Secondary alcohol - Tertiary amine - Azacycle - Dialkylthioether - Sulfenyl compound - Thioether - Amine - Organic nitrogen compound - Primary amine - Organosulfur compound - Organooxygen compound - Organonitrogen compound - Hydrocarbon derivative - Organic oxygen compound - Organopnictogen compound - Alcohol - Aromatic heteropolycyclic compound
설명This compound belongs to the class of organic compounds known as pyrrolopyrimidines. These are compounds containing a pyrrolopyrimidine moiety, which consists of a pyrrole ring fused to a pyrimidine. Pyrrole is 5-membered ring consisting of four carbon atoms and one nitrogen atom. Pyrimidine is a 6-membered ring consisting of four carbon atoms and two nitrogen centers at the 1- and 3- ring positions.
External Descriptors Not available
3D 구조
상호 작용 화학 구조 모델





관련 대상(인간)
MTAP Tchem S-methyl-5'-thioadenosine phosphorylase (4 Activities)
Activity TypeActivity Value -log(M)Mechanism of ActionActivity ReferencePublications (PubMed IDs)
MTAP Tchem S-methyl-5-thioadenosine phosphorylase (233 Activities)
Activity TypeRelationActivity valueUnitsAction TypeJournalPubMed IddoiAssay Aladdin ID
HEK293 (82097 Activities)
Activity TypeRelationActivity valueUnitsAction TypeJournalPubMed IddoiAssay Aladdin ID
관련 대상(비인간)
Pseudomonas aeruginosa (123386 Activities)
Activity TypeRelationActivity valueUnitsAction TypeJournalPubMed IddoiAssay Aladdin ID
Klebsiella pneumoniae (43867 Activities)
Activity TypeRelationActivity valueUnitsAction TypeJournalPubMed IddoiAssay Aladdin ID
Vibrio cholerae (1211 Activities)
Activity TypeRelationActivity valueUnitsAction TypeJournalPubMed IddoiAssay Aladdin ID
Staphylococcus aureus (210822 Activities)
Activity TypeRelationActivity valueUnitsAction TypeJournalPubMed IddoiAssay Aladdin ID
Acinetobacter baumannii (41033 Activities)
Activity TypeRelationActivity valueUnitsAction TypeJournalPubMed IddoiAssay Aladdin ID
Escherichia coli (133304 Activities)
Activity TypeRelationActivity valueUnitsAction TypeJournalPubMed IddoiAssay Aladdin ID
Cryptococcus neoformans (21258 Activities)
Activity TypeRelationActivity valueUnitsAction TypeJournalPubMed IddoiAssay Aladdin ID
Candida albicans (78123 Activities)
Activity TypeRelationActivity valueUnitsAction TypeJournalPubMed IddoiAssay Aladdin ID
rep Replicase polyprotein 1ab (378 Activities)
Activity TypeRelationActivity valueUnitsAction TypeJournalPubMed IddoiAssay Aladdin ID
mtf 5'-methylthioadenosine/S-adenosylhomocysteine nucleosidase (3 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
용해성DMSO : 100 mg/mL (340.84 mM; Need ultrasonic)
분자량293.390 g/mol
XLogP30.000
Hydrogen Bond Donor Count3
Hydrogen Bond Acceptor Count6
Rotatable Bond Count4
Exact Mass293.131 Da
Monoisotopic Mass293.131 Da
Topological Polar Surface Area116.000 Ų
Heavy Atom Count20
Formal Charge0
Complexity334.000
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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