C75 - Moligand™,≥99% , CAS No.218137-86-1

CAS: 218137-86-1 Cat. No.: C646929 분자식: C14H22O4 분자량: 254.32
주문 가능
등급 & 순도 Moligand™ ? Moligand™ — Aladdin's line of ligands and bioactive small molecules. Use for receptor, pathway, and binding studies needing defined small-molecule tools. ≥99%
Synonyms
4-methylidene-2-octyl-5-oxotetrahydrofuran-3-carboxylic acid|4-methylidene-2-octyl-5-oxooxolane-3-carboxylic acid|FAS inhibitor C75|C-75|4-Methylene-2-octyl-5-oxo-tetrahydro-furan-3-carboxylic acid|4-Methylene-2-octyl-5-oxotetrahydrofuran-3-carboxylic acid|C75;C 75;FAS inhibitor C75|tetrahydro-4-methylene-2-octyl-5-oxo-3-furancarboxylic acid|3-Furancarboxylic acid, tetrahydro-4-methylene-2-octyl-5-oxo-
Storage
Store at -20°C
Shipped In
Ice chest + Ice pads
★
크기
USA
독일 (EU)*
가격
수량
5mg
C646929-5mg
주문제작 · 8~12주
US$39.90
25mg
C646929-25mg
주문제작 · 8~12주
US$99.90
100mg
C646929-100mg
주문제작 · 8~12주
US$279.90
Enter a quantity for the sizes you want to add.

개요

C75 is a synthetic fatty-acid synthase (FASN) inhibitor; inhibits prostate cancer cells PC3 with an IC50 of 35 μM[1][2][3]. C75 is a potent CPT1A activator.

사양

동의어
4-methylidene-2-octyl-5-oxotetrahydrofuran-3-carboxylic acid | 4-methylidene-2-octyl-5-oxooxolane-3-carboxylic acid | FAS inhibitor C75 | C-75 | 4-Methylene-2-octyl-5-oxo-tetrahydro-furan-3-carboxylic acid | 4-Methylene-2-octyl-5-oxotetrahydrofuran-3-carboxylic acid | C75;C 75;FAS inhibitor C75 | tetrahydro-4-methylene-2-octyl-5-oxo-3-fur Show more
사양 및 순도
Moligand™,≥99%
보관 조건
Store at -20°C
배송
Ice chest + Ice pads
이 제품은 콜드 체인 배송이 필요합니다.지상 및 기타 경제 서비스는 사용할 수 없습니다.
등급
Moligand™
작업 유형
INHIBITOR
순수함
≥99%
이름과 식별자
정식 스마일
CCCCCCCCC1C(C(=C)C(=O)O1)C(=O)O
IUPAC Name
4-methylidene-2-octyl-5-oxooxolane-3-carboxylic acid
InChIKey
VCWLZDVWHQVAJU-UHFFFAOYSA-N
INCHI
1S/C14H22O4/c1-3-4-5-6-7-8-9-11-12(13(15)16)10(2)14(17)18-11/h11-12H,2-9H2,1H3,(H,15,16)
이성체 SMILES
CCCCCCCCC1C(C(=C)C(=O)O1)C(=O)O
WGK 독일
3
분자량
254.32
Reaxy-Rn
9925444
Reaxys-RN_link_address
https://www.reaxys.com/reaxys/secured/hopinto.do?context=S&query=IDE.XRN=9925444&ln=

고급 데이터

Taxonomic Classification

Taxonomy Tree

KingdomOrganic compounds
SuperclassOrganoheterocyclic compounds
분류Lactones
SubclassGamma butyrolactones
Intermediate Tree Nodes Not available
Direct ParentGamma butyrolactones
Alternative Parents Dicarboxylic acids and derivatives  Tetrahydrofurans  Enoate esters  Oxacyclic compounds  Carboxylic acids  Organic oxides  Hydrocarbon derivatives  Carbonyl compounds  
Molecular FrameworkAliphatic heteromonocyclic compounds
Substituents Gamma butyrolactone - Dicarboxylic acid or derivatives - Alpha,beta-unsaturated carboxylic ester - Enoate ester - Tetrahydrofuran - Carboxylic acid ester - Oxacycle - Carboxylic acid - Carboxylic acid derivative - Organic oxygen compound - Organic oxide - Hydrocarbon derivative - Organooxygen compound - Carbonyl group - Aliphatic heteromonocyclic compound
설명This compound belongs to the class of organic compounds known as gamma butyrolactones. These are compounds containing a gamma butyrolactone moiety, which consists of an aliphatic five-member ring with four carbon atoms, one oxygen atom, and bears a ketone group on the carbon adjacent to the oxygen atom.
External Descriptors Not available
3D 구조
상호 작용 화학 구조 모델





관련 대상(인간)
VDR Tclin Vitamin D receptor (26531 Activities)
Activity TypeRelationActivity valueUnitsAction TypeJournalPubMed IddoiAssay Aladdin ID
FASN Tchem Fatty acid synthase (3390 Activities)
Activity TypeRelationActivity valueUnitsAction TypeJournalPubMed IddoiAssay Aladdin ID
Huh-7 (12904 Activities)
Activity TypeRelationActivity valueUnitsAction TypeJournalPubMed IddoiAssay Aladdin ID
MCF7 (126967 Activities)
Activity TypeRelationActivity valueUnitsAction TypeJournalPubMed IddoiAssay Aladdin ID
OVCAR-3 (48710 Activities)
Activity TypeRelationActivity valueUnitsAction TypeJournalPubMed IddoiAssay Aladdin ID
PC-3 (62116 Activities)
Activity TypeRelationActivity valueUnitsAction TypeJournalPubMed IddoiAssay Aladdin ID
SK-BR-3 (5175 Activities)
Activity TypeRelationActivity valueUnitsAction TypeJournalPubMed IddoiAssay Aladdin ID
MIA PaCa-2 (5949 Activities)
Activity TypeRelationActivity valueUnitsAction TypeJournalPubMed IddoiAssay Aladdin ID
HCT-116 (91556 Activities)
Activity TypeRelationActivity valueUnitsAction TypeJournalPubMed IddoiAssay Aladdin ID
HepG2 (196354 Activities)
Activity TypeRelationActivity valueUnitsAction TypeJournalPubMed IddoiAssay Aladdin ID
MDA-MB-231 (73002 Activities)
Activity TypeRelationActivity valueUnitsAction TypeJournalPubMed IddoiAssay Aladdin ID
POLK Tbio DNA polymerase kappa (8653 Activities)
Activity TypeRelationActivity valueUnitsAction TypeJournalPubMed IddoiAssay Aladdin ID
관련 대상(비인간)
Staphylococcus aureus (210822 Activities)
Activity TypeRelationActivity valueUnitsAction TypeJournalPubMed IddoiAssay Aladdin ID
Moraxella catarrhalis (3334 Activities)
Activity TypeRelationActivity valueUnitsAction TypeJournalPubMed IddoiAssay Aladdin ID
Haemophilus influenzae (8812 Activities)
Activity TypeRelationActivity valueUnitsAction TypeJournalPubMed IddoiAssay Aladdin ID
Mus musculus (284745 Activities)
Activity TypeRelationActivity valueUnitsAction TypeJournalPubMed IddoiAssay Aladdin ID
Rattus norvegicus (775804 Activities)
Activity TypeRelationActivity valueUnitsAction TypeJournalPubMed IddoiAssay Aladdin ID
dengue virus type 2 (2400 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 : ≥ 83.3 mg/mL (327.54 mM) H2O : <0.1 mg/mL (ultrasonic) (insoluble)
분자량254.320 g/mol
XLogP34.000
Hydrogen Bond Donor Count1
Hydrogen Bond Acceptor Count4
Rotatable Bond Count8
Exact Mass254.152 Da
Monoisotopic Mass254.152 Da
Topological Polar Surface Area63.600 Ų
Heavy Atom Count18
Formal Charge0
Complexity322.000
Isotope Atom Count0
Defined Atom Stereocenter Count0
Undefined Atom Stereocenter Count2
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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