アセチルジギトキシン
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出典(authority):フリー百科事典『ウィキペディア(Wikipedia)』「2016/05/27 16:47:50」(JST)
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Acetyldigitoxin
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Systematic (IUPAC) name |
[(2R,3R,4S,6S)-3-Hydroxy-6-[(2R,4S,6S)-4-hydroxy-6-[(2R,3S,4S,6R)-4-hydroxy-6-[ [(5R,8R,9S,10S,13R,14S,17R')-14-hydroxy-10,13-dimethyl-17-(5-oxo-2H-furan-3-yl)-1,2,3,4,5,6,7,8,9,11,12,15,16,17-tetradecahydrocyclopenta[a]phenanthren-3-yl]oxy]-2-methyloxan-3-yl]oxy-2-methyloxan-3-yl]oxy-2-methyloxan-4-yl] acetate
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Identifiers |
CASRN |
1111-39-3 N |
ATC code |
C01AA01 (WHO) |
PubChem |
CID 68949 |
DrugBank |
DB00511 Y |
ChemSpider |
4447572 Y |
UNII |
0ZV4Q4L2FU Y |
KEGG |
D06881 Y |
ChEBI |
CHEBI:53773 Y |
ChEMBL |
CHEMBL1200634 N |
Chemical data |
Formula |
C43H66O14 |
Molar mass |
806.976 g/mol |
SMILES
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O=C\1OC/C(=C/1)[C@H]2CC[C@@]8(O)[C@]2(C)CC[C@H]7[C@H]8CC[C@H]6[C@]7(C)CC[C@H](O[C@@H]5O[C@@H]([C@@H](O[C@@H]4O[C@@H]([C@@H](O[C@@H]3O[C@H](C)[C@@H](O)[C@@H](OC(=O)C)C3)[C@@H](O)C4)C)[C@@H](O)C5)C)C6
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InChI
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InChI=1S/C43H66O14/c1-21-38(48)33(54-24(4)44)19-37(51-21)57-40-23(3)53-36(18-32(40)46)56-39-22(2)52-35(17-31(39)45)55-27-9-12-41(5)26(16-27)7-8-30-29(41)10-13-42(6)28(11-14-43(30,42)49)25-15-34(47)50-20-25/h15,21-23,26-33,35-40,45-46,48-49H,7-14,16-20H2,1-6H3/t21-,22-,23-,26-,27+,28-,29+,30-,31+,32+,33+,35+,36+,37+,38-,39-,40-,41+,42-,43+/m1/s1 Y
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Key:HPMZBILYSWLILX-UMDUKNJSSA-N Y
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NY (what is this?) (verify) |
Acetyldigitoxin is a cardiac glycoside. It is an acetyl derivative of digitoxin.
Cardiac glycosides (C01A)
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Bufadienolides |
Bufo
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- Arenobufagin
- Bufotalin
- Cinobufagin
- Marinobufagin
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Scilla
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- Proscillaridin
- Scilliroside
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Cardenolides |
Digitalis
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- Acetyldigitoxin
- Acetyldigoxin
- Digitoxin#
- Digoxin#
- Lanatoside C
- Deslanoside
- Metildigoxin
- Gitoformate
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Kalanchoe
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Strophanthus
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- Ouabain (g-Strophanthin)
- k-Strophanthin
- Cymarin
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Thevetia
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- #WHO-EM
- ‡Withdrawn from market
- Clinical trials:
- †Phase III
- §Never to phase III
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English Journal
- Antifungal activity of microbial secondary metabolites.
- Coleman JJ1, Ghosh S, Okoli I, Mylonakis E.
- PloS one.PLoS One.2011;6(9):e25321. doi: 10.1371/journal.pone.0025321. Epub 2011 Sep 22.
- Secondary metabolites are well known for their ability to impede other microorganisms. Reanalysis of a screen of natural products using the Caenorhabditis elegans-Candida albicans infection model identified twelve microbial secondary metabolites capable of conferring an increase in survival to infec
- PMID 21966496
- Characterization of minor site probes for human serum albumin by high-performance affinity chromatography.
- Sengupta A1, Hage DS.
- Analytical chemistry.Anal Chem.1999 Sep 1;71(17):3821-7.
- This study used high-performance affinity chromatography (HPAC) and immobilized human serum albumin (HSA) columns to examine the specificity and cross-reactivity of various compounds that have been proposed as markers for the minor binding sites of HSA. These agents included acetyldigitoxin and digi
- PMID 10489529
- Characterisation of the binding of digitoxin and acetyldigitoxin to human serum albumin by high-performance affinity chromatography.
- Hage DS1, Sengupta A.
- Journal of chromatography. B, Biomedical sciences and applications.J Chromatogr B Biomed Sci Appl.1999 Mar 5;724(1):91-100.
- Zonal elution and high-performance affinity chromatography were used to examine interactions of the drugs digitoxin and acetyldigitoxin with the protein human serum albumin (HSA). This was done by injecting small amounts of digitoxin and acetyldigitoxin onto an immobilized HSA column in the presence
- PMID 10202961
Japanese Journal
- Characterisation of the binding of digitoxin and acetyldigitoxin to human serum albumin by high-performance affinity chromatography
- HAGE David S.,SENGUPTA Arundhati
- Journal of chromatography. B, Biomedical sciences and applications 724(1), 91-100, 1999-03-05
- NAID 10024534630
- High-performance liquid chromatography-ionspray mass spectrometry for the specific determination of digoxin and some related cardiac glycosides in human plasma
- TRACQUI A.,KINTZ P.,LUDES B.,MANGIN P.
- Journal of chromatography. B, Biomedical sciences and applications 692(1), 101-109, 1997-04-25
- NAID 10024514196
- Studies on the Constituents of Digitalis purpurea L. XXIV. On the Structures of Purlanosides-A and -B.
- 傍士 和彦
- Chemical & pharmaceutical bulletin 9(7), 566-571, 1961-07-25
- … Further, it was determined that the acetyl groups of acetyldigitoxin-γ and acetyl-gitoxin-γ are in the first digitoxose. …
- NAID 110003618674
Related Links
- acetyldigitoxin (plural acetyldigitoxins) (organic chemistry) A class of cardiac glycoside, an acetyl derivative of digitoxin. Translations [edit] drug Finnish: asetyylidigitoksiini Retrieved from "https://en.wiktionary.org/w/index.php?title" ...
- Read more about the pharmacogenomics of acetyldigitoxin on PharmGKB. ... Disclaimer: The PharmGKB's clinical annotations reflect expert consensus based on clinical evidence and peer-reviewed literature available at the time ...