Cas no 15830-55-4 (8H-Purine-8-thione,6-amino-9-b-D-arabinofuranosyl-7,9-dihydro-)
15830-55-4 structure
Product Name:8H-Purine-8-thione,6-amino-9-b-D-arabinofuranosyl-7,9-dihydro-
CAS No:15830-55-4
MF:C10H13N5O4S
MW:299.306319952011
CID:227031
PubChem ID:2868728
Update Time:2025-04-19
8H-Purine-8-thione,6-amino-9-b-D-arabinofuranosyl-7,9-dihydro- Chemical and Physical Properties
Names and Identifiers
-
- 8H-Purine-8-thione,6-amino-9-b-D-arabinofuranosyl-7,9-dihydro-
- 6-amino-9-[3,4-dihydroxy-5-(hydroxymethyl)oxolan-2-yl]-7H-purine-8-thione
- 8-Mercapto-aza-adenosin
- LS-13802
- 6-Amino-9-pentofuranosyl-9H-purine-8-thiol
- SCHEMBL20579589
- CHEMBL1733591
- AKOS003000753
- Oprea1_136054
- SR-01000219885
- NSC-109162
- ZINC01699577
- NCGC00161959-01
- DTXSID00935888
- 15830-55-4
- NSC109162
- NSC-90395
- NSC107398
- ZINC01580810
- 2-(6-amino-8-mercapto-9H-purin-9-yl)-5-(hydroxymethyl)tetrahydro-3,4-furandiol
- SCHEMBL6672560
- CHEBI:190961
- NSC90395
- 2-(6-amino-8-sulfanylpurin-9-yl)-5-(hydroxymethyl)oxolane-3,4-diol
- SR-01000219885-1
- NSC-107398
- CCG-294360
-
- Inchi： 1S/C10H13N5O4S/c11-7-4-8(13-2-12-7)15(10(20)14-4)9-6(18)5(17)3(1-16)19-9/h2-3,5-6,9,16-18H,1H2,(H,14,20)(H2,11,12,13)
- InChI Key： QILZVYQRHGBEAR-UHFFFAOYSA-N
- SMILES： S=C1NC2C(N)=NC=NC=2N1C1C(C(C(CO)O1)O)O
Computed Properties
- Exact Mass: 299.06900
- Monoisotopic Mass: 299.06882509g/mol
- Isotope Atom Count: 0
- Hydrogen Bond Donor Count: 5
- Hydrogen Bond Acceptor Count: 8
- Heavy Atom Count: 20
- Rotatable Bond Count: 2
- Complexity: 402
- Covalently-Bonded Unit Count: 1
- Defined Atom Stereocenter Count: 0
- Undefined Atom Stereocenter Count : 4
- Defined Bond Stereocenter Count: 0
- Undefined Bond Stereocenter Count: 0
- XLogP3: -1.9
- Topological Polar Surface Area: 169?2
Experimental Properties
- PSA: 178.34000
- LogP: -1.11010
8H-Purine-8-thione,6-amino-9-b-D-arabinofuranosyl-7,9-dihydro- Related Literature
-
1. Fatty acid eutectic mixtures and derivatives from non-edible animal fat as phase change materials?Pau Gallart-Sirvent,Marc Martín,Gemma Villorbina,Mercè Balcells,Aran Solé,Luisa F. Cabeza,Ramon Canela-Garayoa RSC Adv., 2017,7, 24133-24139
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Qiao Song,Angela Bamesberger,Lingyun Yang,Haley Houtwed,Haishi Cao Analyst, 2014,139, 3588-3592
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3. Excimer emission and magnetoluminescence of radical-based zinc(ii) complexes doped in host crystals?Shojiro Kimura,Tetsuro Kusamoto Chem. Commun., 2020,56, 11195-11198
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Shun-Ze Zhan,Mian Li,Xiao-Ping Zhou,Dan Li,Seik Weng Ng RSC Adv., 2011,1, 1457-1459
-
Dhirendra K. Chaudhary,Pramendra Kumar,Lokendra Kumar RSC Adv., 2016,6, 94731-94738
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