ChemicalBook--->CAS DataBase List--->39947-04-1

39947-04-1

39947-04-1 Structure

39947-04-1 Structure
IdentificationBack Directory
[Name]

N6-Benzoyl-2',3'-isopropylideneadenosine
[CAS]

39947-04-1
[Synonyms]

N6-Benzoyl-2',3'-isopropylideneadenosine
N6-Benzoyl-2',3'-O-isopropylideneadenosine
Adenosine, N-benzoyl-2',3'-O-(1-methylethylidene)-
[Molecular Formula]

C20H21N5O5
[MDL Number]

MFCD15145205
[MOL File]

39947-04-1.mol
[Molecular Weight]

411.41
Chemical PropertiesBack Directory
[Melting point ]

144-146 °C
[density ]

1.58±0.1 g/cm3(Predicted)
[form ]

Solid
[pka]

14.14±0.10(Predicted)
[color ]

White to off-white
[InChIKey]

LJKIYWGWKVYJHS-QEPJRFBGSA-N
[SMILES]

OC[C@H]1O[C@@H](N2C3C(=C(N=CN=3)NC(=O)C3=CC=CC=C3)N=C2)[C@@H]2OC(O[C@H]12)(C)C
Hazard InformationBack Directory
[Uses]

N6-Benzoyl-2',3'-isopropylidene adenosine is an adenosine analog. Adenosine analogs mostly act as smooth muscle vasodilators and have also been shown to inhibit cancer progression. Its popular products are adenosine phosphate, Acadesine (HY-13417), Clofarabine (HY-A0005), Fludarabine phosphate (HY-B0028) and Vidarabine (HY-B0277)[1].
[References]

[1] Man S, et al. Potential and promising anticancer drugs from adenosine and its analogs. Drug Discov Today. 2021 Jun;26(6):1490-1500. DOI:10.1016/j.drudis.2021.02.020
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