Introduction：Basic information about CAS 23526-02-5|D-Allaric acid,O-5'-deoxyadenosin-5'-yl-(5'®4)-O-a-D-glucopyra, including its chemical name, molecular formula, synonyms, physicochemical properties, and safety information, etc.
| Common Name | D-Allaric acid,O-5'-deoxyadenosin-5'-yl-(5'®4)-O-a-D-glucopyranosyl-(1®2)-, 4-(dihydrogen phosphate) |
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| CAS Number | 23526-02-5 | Molecular Weight | 701.48500 |
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| Density | 2.27g/cm3 | Boiling Point | 1263.8ºC at 760mmHg |
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| Molecular Formula | C22H32N5O19P | Melting Point | / |
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| MSDS | / | Flash Point | 718.1ºC |
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Names
| Name | thuringiensin |
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| Synonym | More Synonyms |
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Chemical & Physical Properties
| Density | 2.27g/cm3 |
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| Boiling Point | 1263.8ºC at 760mmHg |
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| Molecular Formula | C22H32N5O19P |
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| Molecular Weight | 701.48500 |
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| Flash Point | 718.1ºC |
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| Exact Mass | 701.14300 |
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| PSA | 399.32000 |
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| Vapour Pressure | 0mmHg at 25°C |
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| Index of Refraction | 1.823 |
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| InChIKey | OTLLEIBWKHEHGU-TUNUFRSWSA-N |
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| SMILES | Nc1ncnc2c1ncn2C1OC(COC2C(CO)OC(OC(C(=O)O)C(O)C(OP(=O)(O)O)C(O)C(=O)O)C(O)C2O)C(O)C1O |
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Toxicological Information
CHEMICAL IDENTIFICATION - RTECS NUMBER :
- BA0270000
- CHEMICAL NAME :
- D-Allaric acid, O-5'-deoxyadenosinyl-(5'-4)-O-3,6-anhydro-alpha-D-glu copyranosyl-(1-2)-, 4-(dihydrogenphosphate)
- CAS REGISTRY NUMBER :
- 23526-02-5
- LAST UPDATED :
- 199306
- DATA ITEMS CITED :
- 9
- MOLECULAR FORMULA :
- C22-H30-N5-O18-P
- MOLECULAR WEIGHT :
- 683.54
HEALTH HAZARD DATAACUTE TOXICITY DATA - TYPE OF TEST :
- LD50 - Lethal dose, 50 percent kill
- ROUTE OF EXPOSURE :
- Intravenous
- SPECIES OBSERVED :
- Rodent - rat
- DOSE/DURATION :
- >300 mg/kg
- TOXIC EFFECTS :
- Details of toxic effects not reported other than lethal dose value
- TYPE OF TEST :
- LD50 - Lethal dose, 50 percent kill
- ROUTE OF EXPOSURE :
- Unreported
- SPECIES OBSERVED :
- Rodent - rat
- DOSE/DURATION :
- 390 mg/kg
- TOXIC EFFECTS :
- Details of toxic effects not reported other than lethal dose value
- TYPE OF TEST :
- LD50 - Lethal dose, 50 percent kill
- ROUTE OF EXPOSURE :
- Unreported
- SPECIES OBSERVED :
- Rodent - mouse
- DOSE/DURATION :
- 672 mg/kg
- TOXIC EFFECTS :
- Details of toxic effects not reported other than lethal dose value
- TYPE OF TEST :
- LD50 - Lethal dose, 50 percent kill
- ROUTE OF EXPOSURE :
- Unreported
- SPECIES OBSERVED :
- Rodent - rabbit
- DOSE/DURATION :
- 300 mg/kg
- TOXIC EFFECTS :
- Details of toxic effects not reported other than lethal dose value
- TYPE OF TEST :
- LD50 - Lethal dose, 50 percent kill
- ROUTE OF EXPOSURE :
- Unreported
- SPECIES OBSERVED :
- Rodent - guinea pig
- DOSE/DURATION :
- 175 mg/kg
- TOXIC EFFECTS :
- Details of toxic effects not reported other than lethal dose value
- TYPE OF TEST :
- Sex chromosome loss and nondisjunction
MUTATION DATA - TEST SYSTEM :
- Rodent - rat
- DOSE/DURATION :
- 4500 gm/kg/90D (Continuous)
- REFERENCE :
- HEREAY Hereditas (Lund, Sweden). (Gjoerloffsgatan 121, S-261 34 Landskrona, Sweden) V.1- 1947- Volume(issue)/page/year: 85,105,1977
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Synonyms
| Exotoxin |
| Bacillus thuringiensis exotoxin |
| (2R,3S,4S,5S)-2-{[(2R,3R,4R,5S,6R)-5-{[(2R,3S,4R,5R)-5-(6-amino-9H-purin-9-yl)-3,4-dihydroxytetrahydrofuran-2-yl]methoxy}-3,4-dihydroxy-6-(hydroxymethyl)tetrahydro-2H-pyran-2-yl]oxy}-3,5-dihydroxy-4-(phosphonooxy)hexanedioic acid |
| Bacillus thuringiensis B toxin |
| O-5’-deoxyadenosin-5’-yl-(5’→4)-O-α-D-glucopyranosyl-(1→2)-D-allaric acid 4-(dihydrogen phosphate) |
| Thuringiensin |
| 2-[5-[[5-(6-aminopurin-9-yl)-3,4-dihydroxyoxolan-2-yl]methoxy]-3,4-dihydroxy-6-(hydroxymethyl)oxan-2-yl]oxy-3,5-dihydroxy-4-phosphonooxyhexanedioic acid |
| Turingin-1[Russian] |
| Thuringiensin A |
| Thurintox |
