4-Epianhydrochlortetracycline Hydrochloride

HCID 54710413CAS 158018-53-2

기본 정보

표준 SMILES: Cc1c2c(c(O)c3c(O)ccc(Cl)c13)C(=O)[C@]1(O)C(O)=C(C(N)=O)C(=O)[C@H](N(C)C)[C@@H]1C2.Cl
InChIKey: WIOSVFADOBZUQR-PXAZKYFKSA-N
분자식: C22H22Cl2N2O7
평균 분자량: 497.3 g/mol

이름 및 식별자

우선 이름: 4-Epianhydrochlortetracycline Hydrochloride
IUPAC: (4R,4aS,12aR)-7-chloro-4-(dimethylamino)-1,10,11,12a-tetrahydroxy-6-methyl-3,12-dioxo-4a,5-dihydro-4H-tetracene-2-carboxamide;hydrochloride
영어명: 4-Epianhydrochlortetracycline hydrochloride, CAN be used as secondary standard
분자식: C22H21ClN2O7.ClH
분자량: 497.329

이름 및 동의어

158018-53-24-Epianhydrochlortetracycline Hydrochloride4-Epianhydrochlortetracycline (hydrochloride)(4R,4aS,12aR)-7-chloro-4-(dimethylamino)-1,10,11,12a-tetrahydroxy-6-methyl-3,12-dioxo-4a,5-dihydro-4H-tetracene-2-carboxamide;hydrochloride(4R,4aS,12aS)-7-chloro-4-(dimethylamino)-3,10,11,12a-tetrahydroxy-6-methyl-1,12-dioxo-1,4,4a,5,12,12a-hexahydrotetracene-2-carboxamide hydrochlorideorb1694171CHEMBL1950581DTXSID80716137MSK4128AKOS040754949PD063967HY-120715

이름 더 보기

4-epi-Anhydrochlortetracycline HCl4-Epianhydrochlortetracycline(EACTC)Tetracycline impurity 11 (hydrochloride)Epianhydrochlortetracycline hydrochloride4-EPIANHYDROCHLORTETRACYCLINE HYDROCHLORIDE, CAN B4-Epianhydrochlortetracycline Hydrochloride in Methanol4-EPIANHYDROCHLORTETRACYCLINE HYDROCHLORIDE, CAN BE USED AS SECONDARY STANDARD USP/EP/BP[4R-(4α,4aβ,12aβ)]-7-Chloro-4-(diMethylaMino)-1,4,4a,5,12,12a-hexahydro-3,10,11,12a-tetrahydroxy-6-Methyl-1,12-dioxo-2-naphthacenecarboxaMide Monohydrochloride

T359504-Epianhydrochlortetracycline Hydrochloride (>90%)4-Epianhydrochlortetracycline hydrochloride, can be used as secondary standard(4R,4aS,12aS)-7-Chloro-4-(dimethylamino)-3,10,11,12a-tetrahydroxy-6-methyl-1,12-dioxo-1,4,4a,5,12,12a-hexahydrotetracene-2-carboxamide--hydrogen chloride (1/1)2-Naphthacenecarboxamide, 7-chloro-4-(dimethylamino)-1,4,4a,5,12,12a-hexahydro-3,10,11,12a-tetrahydroxy-6-methyl-1,12-dioxo-, hydrochloride(1:1), (4R,4aS,12aS)-

데이터베이스 식별자

CAS: 158018-53-2
PubChem CID: 54710413
DTXSID: DTXSID80716137
ChEMBL: CHEMBL1950581

물성

구조 계산 물성

극성 표면적: 161 Å²
수소 결합 공여자 수: 6
수소 결합 수용자 수: 8
회전 가능 결합 수: 2
무거운 원자 수: 33
형식 전하: 0
복잡도: 892

물리화학적 성질

녹는점: 222 °C · 222°C
저장 조건: -20 °C · Hygroscopic, -20°C Freezer, Under Inert Atmosphere
용해도: DMF: Soluble; DMSO: Soluble; Ethanol: Soluble; Methanol: Soluble
물리적 상태: 가루
색상: 오렌지 레드
안정성: 흡습성
EPA: 2 · 2-Naphthacenecarboxamide, 7-chloro-4-(dimethylamino)-1,4,4a,5,12,12a-hexahydro-3,10,11,12a-tetrahydroxy-6-methyl-1,12-dioxo-, hydrochloride(1:1), (4R,4aS,12aS)- (158018-53-2)

화학적 성질

orange powder

안전 및 규제

안전 데이터

HS 번호: 29413000

화학 및 산업

응용 분야

용도Modified Tetracycline analog

공급사30 곳

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