AG00BXWP

34079-68-0 | (2R,3S,4S,5R)-2-(2,6-Diamino-9H-purin-9-yl)-5-(hydroxymethyl)tetrahydrofuran-3,4-diol

AG00BXWP

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CAS Number	34079-68-0
Catalog Number	AG00BXWP(AGN-PC-0R9J2N)
Chemical Name	(2R,3S,4S,5R)-2-(2,6-Diamino-9H-purin-9-yl)-5-(hydroxymethyl)tetrahydrofuran-3,4-diol
IUPAC Name	(2R,3S,4S,5R)-2-(2,6-diaminopurin-9-yl)-5-(hydroxymethyl)oxolane-3,4-diol
InChI	InChI=1S/C10H14N6O4/c11-7-4-8(15-10(12)14-7)16(2-13-4)9-6(19)5(18)3(1-17)20-9/h2-3,5-6,9,17-19H,1H2,(H4,11,12,14,15)/t3-,5-,6+,9-/m1/s1
InChI Key	ZDTFMPXQUSBYRL-FJFJXFQQSA-N
MDL Number	MFCD03788199
Molecular Formula	C10H14N6O4
Molecular Weight	282.2560
SMILES	NC1=C2N=CN([C@H]3[C@H]([C@@H]([C@@H](CO)O3)O)O)C2=NC(N)=N1
Synonyms	2,6-diamino-9 beta-arabinofuranosylpurine, 2,6-diaminopurine arabinoside, 2,6-diaminopurine-9-beta-D-arabinofuranoside, ara-DAP, araDAP, 34079-68-0, Ara-dap, araDAPR, 2,6-Diaminopurine arabinoside, 2,6-Diamino-9-(b-D-arabinofuranosyl)purine, 9H-Purine-2,6-diamine, 9-b-D-xylofuranosyl-, 19768-89-9, sra-DAP, 2,6-Diamino-9 beta-arabinofuranosylpurine, 9-beta-D-Arabinofuranosyl-2,6-diaminopurine, 2,6-Diaminopurine-9-beta-D-arabinofuranoside, AC1Q4XY4, 9h-purine-2,6-diamine, 9-|A-d-arabinofuranosyl-, SCHEMBL972927, AC1L2K94, CHEMBL2093967, CTK8F3861, (2R,3S,4S,5R)-2-(2,6-diaminopurin-9-yl)-5-(hydroxymethyl)oxolane-3,4-diol, ZDTFMPXQUSBYRL-FJFJXFQQSA-N, BCP11996, MFCD03788199, ZINC14920360, AKOS027384079, 2,6-Diaminopurine-9-arabinoside, 97%, FT-0601309, 2,6-Diamino-9-(beta-D-arabinofuranosyl)purine, 9-(?-D-Arabinofuranosyl)-2,6-diamino-purine, 9-.beta.-D-Arabinofuranosyl-2,6-diaminopurine, 9H-Purine-2,6-diamine, 9-beta-D-arabinofuranosyl-, (2R,3S,4S,5R)-2-(2,6-diaminopurin-9-yl)-5-(hydroxymethyl)tetrahydrofuran-3,4-diol, 2-Aminoadenosine, CID73662, 2,6-DIAMINOPURINEARABINOSIDE, AR-1H5762, C10-H14-N6-O4, 9-(beta-D-arabinofuranosyl)-9H-purine-2,6-diamine, (2R,3S,4S,5R)-2-(2,6-Diamino-9H-purin-9-yl)-5-(hydroxymethyl)tetrahydrofuran-3,4-diol, 35278-77-4,

Complexity	363
Compound Is Canonicalized	Yes
Covalently-Bonded Unit Count	1
Defined Atom Stereocenter Count	4
Defined Bond Stereocenter Count	0
Exact Mass	282.108g/mol
Formal Charge	0
Heavy Atom Count	20
Hydrogen Bond Acceptor Count	9
Hydrogen Bond Donor Count	5
Isotope Atom Count	0
Molecular Weight	282.26g/mol
Monoisotopic Mass	282.108g/mol
Rotatable Bond Count	2
Topological Polar Surface Area	166A^2
Undefined Atom Stereocenter Count	0
Undefined Bond Stereocenter Count	0
XLogP3	-1.4

GHS Hazard and Precautionary Statements

Symbol:
Hazard Class	6.1
Hazard statements	H301
Packing Group	Ⅲ
Precautionary statements	P301+P310
UN Code	UN 2811

Certificate of Analysis

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