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173346-59-3 | Guanosine, 2'-deoxy-N-(1-oxo-4-pentenyl)- (9CI)
CAS No: 173346-59-3 Catalog No: AG001YTV MDL No:
Product Description
Catalog Number:
AG001YTV
Chemical Name:
Guanosine, 2'-deoxy-N-(1-oxo-4-pentenyl)- (9CI)
CAS Number:
173346-59-3
Molecular Formula:
C15H19N5O5
Molecular Weight:
349.3419
IUPAC Name:
N-[9-[(2R,4S,5R)-4-hydroxy-5-(hydroxymethyl)oxolan-2-yl]-6-oxo-1H-purin-2-yl]pent-4-enamide
InChI:
InChI=1S/C15H19N5O5/c1-2-3-4-10(23)17-15-18-13-12(14(24)19-15)16-7-20(13)11-5-8(22)9(6-21)25-11/h2,7-9,11,21-22H,1,3-6H2,(H2,17,18,19,23,24)/t8-,9+,11+/m0/s1
InChI Key:
QSDRVOSIMAYNSQ-IQJOONFLSA-N
SMILES:
C=CCCC(=O)Nc1[nH]c(=O)c2c(n1)n(cn2)[C@H]1C[C@@H]([C@H](O1)CO)O
Properties
Complexity:
583
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1
Defined Atom Stereocenter Count:
3
Defined Bond Stereocenter Count:
0
Exact Mass:
349.139g/mol
Formal Charge:
0
Heavy Atom Count:
25
Hydrogen Bond Acceptor Count:
7
Hydrogen Bond Donor Count:
4
Isotope Atom Count:
0
Molecular Weight:
349.347g/mol
Monoisotopic Mass:
349.139g/mol
Rotatable Bond Count:
6
Topological Polar Surface Area:
138A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
XLogP3:
0.3
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