CAS 1672-46-4 MFCD00871861-Digoxigenin 地高辛配基 TAO{mole}

Digoxigenin 地高辛配基

CAS 1672-46-4 MFCD00871861

化学结构图

SMILES: C[C@]12CC[C@H](O)C[C@H]1CC[C@@H]1[C@@H]2C[C@@H](O)[C@]2(C)[C@@H](C3=CC(=O)OC3)CC[C@]12O

化学属性

Mol. Formula	C23 H34 O5
Mol. Weight	390.51
Melting Point	>200°C (dec.)
Boiling Point
Flash Point	-

别名和识别编码

Chemical Name	Digoxigenin
Synonym	(3beta,5beta,12beta)-3,12,14-trihydroxycard-20(22)-enolide (3β,5β,12β)-3,12,14-trihydroxycard-20(22)-enolide 20(22),5BETA-CARDENOLID 3,12,14-trihydroxy-,(3-beta,5-beta,12-beta)-card-20(22)-enolid 3-beta,12,14-trioxy-carden-(20:22)-olid 3-beta,12,14-trioxy-digen-(20:22)-olid 3-beta,12-beta,14-trihydroxy-5-beta-card-20(22)-enolid 3-beta,12-beta,14-trihydroxy-card-20(22)-enolide 3-β,12-β-14-Trihydroxycard-20(22)enolide 3BETA,12BETA,14-TRIHYDROXY-5BETA,20[22]-CARDENOLIDE 3BETA,12BETA,14BETA,21-TETRAHYDROXY-20(22) NORCHOLENIC ACID LACTONE 3β,12β,14β,21-tetrahydroxy-20(22)-norcholenic acid lactone 5β,20(22)-Cardenolide-3β,12β,14-triol 5β,20(22)-Cardenolide-3β,12β,14-triol 异羟基洋地黄毒苷元毛地黄叶毒苷毛地黄毒苷 5BETA,20[22]-CARDENOLIDE-3BETA,12BETA,14-T
MDL Number	-
PubChem Substance ID	15478
Beilstein Registry Number	0096479
CAS Number	1672-46-4
EC Number	216-806-2
Chemical Name Translation	地高辛配基
Merck Number	13,3188
Wiswesser Line Notation	L E5 B666TJ A1 DQ E1 F- DT5OV CUTJ IQ OQ
InChI	InChI=1S/C23H34O5/c1-21-7-5-15(24)10-14(21)3-4-17-18(21)11-19(25)22(2)16(6-8-23(17,22)27)13-9-20(26)28-12-13/h9,14-19,24-25,27H,3-8,10-12H2,1-2H3/t14-,15+,16-,17-,18+,19-,21+,22+,23+/m1/s1
Canonical SMILES	-

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分类

{SNA} 1694 Pharmaceuticals & Personal Care Products, Alphabetical Index of Analytical Standards, Analytical Standards, Biochemicals and Reagents, Chemical Structure, Chromatography, Conjugates, D, DID - DIN, Drugs & Metabolites, Drugs of Abuse, EPA, Forensic and Veterinary Standards, Method and Regulation Specific, Neat Compounds, Neats, Steroid, Sterol Lipids, 分析/色谱, 脂类
{SNA} Analytical Standards, Chromatography, EP Standards, EP Standards C - D, Pharmaceutical Standards, Pharmac

安全信息

WGK Germany3

GHS Symbol

Precautionary statements

P260 Do not breathe dust/fume/gas/mist/vapours/spray. 不要吸入粉尘/烟/气体/烟雾/蒸汽/喷雾。
P262 Do not get in eyes, on skin, or on clothing. 不要接触眼睛，皮肤或衣服。
P264 Wash hands thoroughly after handling. 处理后要彻底洗净双手。
P270 Do not eat, drink or smoke when using this product. 使用本产品时不要吃东西，喝水或吸烟。
P271 Use only outdoors or in a well-ventilated area.? 只能在室外或通风良好的地方使用。
P280 Wear protective gloves/protective clothing/eye protection/face protection. 戴防护手套/防护服/眼睛的保护物/面部保护物。
P284 Wear respiratory protection.? 佩戴呼吸保护装置。
P301+P310
P302+P350
P304+P340
P310 Immediately call a POISON CENTER or doctor/physician. 立即呼救解毒中心或医生/医师。
P320 Specific treatment is urgent (see … on this label). 紧急具体治疗（见本标签上的）。
P321 Specific treatment (see … on this label). 具体治疗（见本标签上的）。
P322 Specific measures (see …on this label). 具体治疗（见本标签上的）。
P330 Rinse mouth. 漱口
P361 Remove/Take off immediately all contaminated clothing. 立即去除/脱掉所有被污染的衣服。
P363 Wash contaminated clothing before reuse. 被污染的衣服洗净后方可重新使用。
P403+P233
P405 Store locked up. 上锁保管。
P501 Dispose of contents/container to..… 处理内容物/容器.....

Hazard statements

H300 Fatal if swallowed 吞食致命
H310 Fatal in contact with skin 皮肤接触致命
H330 Fatal if inhaled 吸入致命

Hazard Codes T+

Signal word Danger

RTECSFH5390000

Safety Statements

S36/37/39 Wear suitable protective clothing, gloves and eye/face protection 穿戴适当的防护服、手套和眼睛/面保护；
S45 In case of accident or if you feel unwell seek medical advice immediately (show the label where possible) 发生事故时或感觉不适时，立即求医（可能时出示标签）；

Risk Statements

R26/27/28 Very toxic by inhalation, in contact with skin and if swallowed 吸入，皮肤接触及吞食都有剧毒

Packing GroupII

Hazard Class6.1(a)

UN Number UN 2811 6.1/PG 1

TYPE OF TEST            : LDLo - Lowest published lethal dose
ROUTE OF EXPOSURE       : Unreported
SPECIES OBSERVED        : Mammal - cat
DOSE/DURATION           : 285 ug/kg
TOXIC EFFECTS :
   Details of toxic effects not reported other than lethal dose value
REFERENCE :
   85ELDJ "Die Herzwirksamen Glykoside," Baumgarten, G., and W. Forster,
   Leipzig, Ger. Dem. Rep., VEB Georg Thieme, 1963  Volume(issue)/page/year:
   -,55,1963

TYPE OF TEST            : LDLo - Lowest published lethal dose
ROUTE OF EXPOSURE       : Intravenous
SPECIES OBSERVED        : Rodent - guinea pig
DOSE/DURATION           : 3545 ug/kg
TOXIC EFFECTS :
   Brain and Coverings - recordings from specific areas of CNS
   Behavioral - convulsions or effect on seizure threshold
   Cardiac - other changes
REFERENCE :
   AIPTAK Archives Internationales de Pharmacodynamie et de Therapie. (Heymans
   Institute of Pharmacology, De Pintelaan 185, B-9000 Ghent, Belgium)  V.4-   
   1898-  Volume(issue)/page/year: 153,436,1965

TYPE OF TEST            : LDLo - Lowest published lethal dose
ROUTE OF EXPOSURE       : Intravenous
SPECIES OBSERVED        : Mammal - cat
DOSE/DURATION           : 244 ug/kg
TOXIC EFFECTS :
   Gastrointestinal - nausea or vomiting
REFERENCE :
   JPHAA3 Journal of the American Pharmaceutical Association.  (Washington, DC)
    V.1-28, 1912-39; New series: V.1-17, 1961-77. Volume(issue)/page/year:
   27,189,1938

TYPE OF TEST            : LDLo - Lowest published lethal dose
ROUTE OF EXPOSURE       : Parenteral
SPECIES OBSERVED        : Bird - pigeon
DOSE/DURATION           : 1620 ug/kg
TOXIC EFFECTS :
   Details of toxic effects not reported other than lethal dose value
REFERENCE :
   CPBTAL Chemical and Pharmaceutical Bulletin.  (Japan Pub. Trading Co., USA,
   1255 Howard St., San Francisco, CA 94103)  V.6-    1958-
   Volume(issue)/page/year: 8,18,1960

Storage condition +4°C 2-8°C 4 4°C 4℃

其他信息

MOL 文件:1672-46-4.mol
Sigma Aldrich:1672-46-4(sigmaaldrich)