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Structure

6-Thioinosine 2',3',5'-triacetate

CAS
3021-21-4
Catalog Number
ACM3021214
Category
Other Products
Molecular Weight
410.401720 [g/mol]
Molecular Formula
C16H18N4O7S

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Specification

Synonyms
Oprea1_683392, BI 293, NSC66385, NSC83295, NSC92028, NSC98668, NSC101763, CID3990558, Inosine, 6-thio-, 2,3,5-triacetate, 9-.beta.-d-Arabinofuranosyl-9H-purine-6-thiol triacetate ester, 9H-Purine-6-thiol, 9-.beta.-D-ribofuranosyl-, 2,3,5-triacetate, 3021-21-4, 4754-05-6, 7687-42-5
IUPAC Name
[3,4-diacetyloxy-5-(6-sulfanylidene-3H-purin-9-yl)oxolan-2-yl]methyl acetate
Canonical SMILES
CC(=O)OCC1C(C(C(O1)N2C=NC3=C2NC=NC3=S)OC(=O)C)OC(=O)C
InChI Key
MENHRYRSGYYUJA-UHFFFAOYSA-N
Boiling Point
622.3ºC at 760mmHg
Flash Point
330.1ºC
Density
1.61g/cm³
EC Number
221-169-9
Exact Mass
410.09000
H-Bond Acceptor
9
H-Bond Donor
1
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