149091-93-0
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Basic information
- Product Name: [(2R,3R,4R,5R)-3-[(2R,3R,4S,5R,6R)-6-(acetyloxymethyl)-3-hydroxy-4,5-d iphosphonooxy-oxan-2-yl]oxy-5-(6-aminopurin-9-yl)-4-hydroxy-oxolan-2-y l]methoxyphosphonic acid
- Synonyms: [(2R,3R,4R,5R)-3-[(2R,3R,4S,5R,6R)-6-(acetyloxymethyl)-3-hydroxy-4,5-d iphosphonooxy-oxan-2-yl]oxy-5-(6-aminopurin-9-yl)-4-hydroxy-oxolan-2-y l]methoxyphosphonic acid;adenophostin B
- CAS NO:149091-93-0
- Molecular Formula: C18H28N5O19P3
- Molecular Weight: 711.358303
- EINECS: N/A
- Product Categories: N/A
- Mol File: 149091-93-0.mol
- Article Data: 0
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Chemical Properties
- Melting Point: N/A
- Boiling Point: 1130.7°Cat760mmHg
- Flash Point: 637.6°C
- Appearance: /
- Density: 2.35g/cm3
- Vapor Pressure: 0mmHg at 25°C
- Refractive Index: 1.812
- Storage Temp.: N/A
- Solubility: N/A
- PKA: 1.83±0.10(Predicted)
- CAS DataBase Reference: [(2R,3R,4R,5R)-3-[(2R,3R,4S,5R,6R)-6-(acetyloxymethyl)-3-hydroxy-4,5-d iphosphonooxy-oxan-2-yl]oxy-5-(6-aminopurin-9-yl)-4-hydroxy-oxolan-2-y l]methoxyphosphonic acid(CAS DataBase Reference)
- NIST Chemistry Reference: [(2R,3R,4R,5R)-3-[(2R,3R,4S,5R,6R)-6-(acetyloxymethyl)-3-hydroxy-4,5-d iphosphonooxy-oxan-2-yl]oxy-5-(6-aminopurin-9-yl)-4-hydroxy-oxolan-2-y l]methoxyphosphonic acid(149091-93-0)
- EPA Substance Registry System: [(2R,3R,4R,5R)-3-[(2R,3R,4S,5R,6R)-6-(acetyloxymethyl)-3-hydroxy-4,5-d iphosphonooxy-oxan-2-yl]oxy-5-(6-aminopurin-9-yl)-4-hydroxy-oxolan-2-y l]methoxyphosphonic acid(149091-93-0)
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Safety Data
- Hazard Codes: N/A
- Statements: N/A
- Safety Statements: N/A
- WGK Germany:
- RTECS:
- HazardClass: N/A
- PackingGroup: N/A
- Hazardous Substances Data: 149091-93-0(Hazardous Substances Data)
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General Description
The chemical compound [(2R,3R,4R,5R)-3-[(2R,3R,4S,5R,6R)-6-(acetyloxymethyl)-3-hydroxy-4,5-diphosphonooxy-oxan-2-yl]oxy-5-(6-aminopurin-9-yl)-4-hydroxy-oxolan-2-yl]methoxyphosphonic acid is a complex molecule with a highly structured arrangement of atoms. It contains several functional groups, including hydroxyl, phosphate, and acetyloxymethyl. The compound is composed of phosphoric acid, a 6-aminopurine derivative, and a sugar-like molecule. The compound is a potent inhibitor of enzymes involved in nucleic acid synthesis and has potential applications in pharmaceutical research and drug development.Check Digit Verification of cas no
The CAS Registry Mumber 149091-93-0 includes 9 digits separated into 3 groups by hyphens. The first part of the number,starting from the left, has 6 digits, 1,4,9,0,9 and 1 respectively; the second part has 2 digits, 9 and 3 respectively.Calculate Digit Verification of CAS Registry Number 149091-93:
(8*1)+(7*4)+(6*9)+(5*0)+(4*9)+(3*1)+(2*9)+(1*3)=150
150 % 10 = 0
So 149091-93-0 is a valid CAS Registry Number.
InChI:InChI=1/C18H28N5O19P3/c1-6(25)36-3-8-12(40-43(27,28)29)13(41-44(30,31)32)10(26)18(38-8)39-11-7(2-24)37-17(14(11)42-45(33,34)35)23-5-22-9-15(19)20-4-21-16(9)23/h4-5,7-8,10-14,17-18,24,26H,2-3H2,1H3,(H2,19,20,21)(H2,27,28,29)(H2,30,31,32)(H2,33,34,35)/t7-,8-,10-,11-,12-,13-,14-,17-,18-/m1/s1
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[(2R,3R,4R,5R)-3-[(2R,3R,4S,5R,6R)-6-(acetyloxymethyl)-3-hydroxy-4,5-d iphosphonooxy-oxan-2-yl]oxy-5-(6-aminopurin-9-yl)-4-hydroxy-oxolan-2-y l]methoxyphosphonic acid
