타이로신,3-아세테이트4B-(3-메틸부타노에이트)

Tylvalosin

HCID 6441094
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기본 정보

CAS
63409-12-1
표준 SMILES
CC[C@H]1OC(=O)C[C@@H](OC(C)=O)[C@H](C)[C@@H](O[C@@H]2O[C@H](C)[C@@H](O[C@H]3C[C@@](C)(O)[C@@H](OC(=O)CC(C)C)[C@H](C)O3)[C@H](N(C)C)[C@H]2O)[C@@H](CC=O)C[C@@H](C)C(=O)/C=C/C(C)=C/[C@@H]1CO[C@@H]1O[C@H](C)[C@@H](O)[C@@H](OC)[C@H]1OC
InChIKey
KCJJINQANFZSAM-HZDSEHBESA-N
분자식
C53H87NO19
평균 분자량
1,042.3 g/mol
단동위원소 질량
1,041.58722956

이름 및 식별자

우선 이름
Tylvalosin
IUPAC
[(2S,3S,4R,6S)-6-[(2R,3S,4R,5R,6R)-6-[[(4R,5S,6S,7R,9R,11E,13E,15R,16R)-4-acetyloxy-16-ethyl-15-[[(2R,3R,4R,5R,6R)-5-hydroxy-3,4-dimethoxy-6-methyloxan-2-yl]oxymethyl]-5,9,13-trimethyl-2,10-dioxo-7-(2-oxoethyl)-1-oxacyclohexadeca-11,13-dien-6-yl]oxy]-4-(dimethylamino)-5-hydroxy-2-methyloxan-3-yl]oxy-4-hydroxy-2,4-dimethyloxan-3-yl] 3-methylbutanoate
현지명
타이로신,3-아세테이트4B-(3-메틸부타노에이트)
영어명
Tylosin, 3-acetate 4B-(3-methylbutanoate)
분자식
C53H87NO19
분자량
1042.25

이름 및 동의어

TYLVALOSIN63409-12-1tilvalosinatylvalosineTylosin acetate isovalerte9T02S42WQOTYLVALOSIN (EMA EPAR: VETERINARY)DTXSID901016510tylvalosinumAivlosin 17%RefChem:58239DTXCID301474699
이름 더 보기
타이로신,3-아세테이트4B-(3-메틸부타노에이트)ACETYLISOVALERYLTYLOSINTiamphenicolTylvalosin (>Tylvalosin (>90%)Aivlosin，TylvalosinKCJJINQANFZSAM-XRMHJPERSA-N3-O-Acetyl-4''-O-isovaleryltylosinAcetylisovaleryltylosin/ tylvalosin
264-132-2((2S,3S,4R,6S)-6-((2R,3S,4R,5R,6R)-6-(((4R,5S,6S,7R,9R,11E,13E,15R,16R)-4-acetyloxy-16-ethyl-15-(((2R,3R,4R,5R,6R)-5-hydroxy-3,4-dimethoxy-6-methyloxan-2-yl)oxymethyl)-5,9,13-trimethyl-2,10-dioxo-7-(2-oxoethyl)-1-oxacyclohexadeca-11,13-dien-6-yl)oxy)-4-(dimethylamino)-5-hydroxy-2-methyloxan-3-yl)oxy-4-hydroxy-2,4-dimethyloxan-3-yl) 3-methylbutanoateTYLOSIN ACETATE ISOVALERATETylvalosin [USAN]Tylvalosin [USAN:INN]EINECS 264-132-2UNII-9T02S42WQO3-Acetyl-4''-isovaleryltylosin

데이터베이스 식별자

CAS
63409-12-1
PubChem CID
6441094
DTXSID
DTXSID901016510
ChEMBL
CHEMBL2103834
UNII
9T02S42WQO
EC Number
264-132-2
Nikkaji
J3.762.464K

물성

구조 계산 물성

XLogP
3.4
극성 표면적
251 Ų
수소 결합 공여자 수
3
수소 결합 수용자 수
20
회전 가능 결합 수
19
무거운 원자 수
73

실험 및 물리화학적 성질

Animal Drugs · 4건

EMA approved medicines: Veterinary medicine

Active Ingredients (Tylvalosin) -> FDA Greenbook

Pharmaceuticals -> UK Veterinary Medicines Directorate List

Pharmaceuticals -> Animal Drugs -> Approved in Taiwan

물리화학적 성질

녹는점
105 °C · >105°C (dec.)
끓는 점
1005.4 · 1005.4±65.0 °C(Predicted)
밀도
1.21 · 1.21±0.1 g/cm3(Predicted)
저장 조건
-20 °C · -20°C Freezer, Under Inert Atmosphere
용해도
클로로포름(약간 용해됨), 메탄올(약간 용해됨)
산도 계수 (pKa)
13.06 · 13.06±0.70(Predicted)

화학 및 산업

약리 정보

ATC CodeQJ - Antiinfectives for systemic use

용도 및 제조

Use Classification · 2건

Animal Drugs -> FDA Approved Animal Drug Products (Green Book) -> Active Ingredients

Pharmaceuticals -> Animal Drugs -> Approved in Taiwan

응용 분야

용도Tylvalosin is an anti-bacterial agent that is shown through study as a good inhibitor of gram-positive bacteria.

공급사26 곳

陕西缔都医药有限责任公司029-81124775 17791530730 · [email protected]
艾吉析科技（上海）有限公司17717235263 · [email protected]
Aladdin Scientific[email protected]
LGM Pharma1-(800)-881-8210 · [email protected]
安耐吉化学&3A（安徽泽升科技有限公司）021-58432009 400-005-6266 · [email protected]

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