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Adenosine, 2-amino-N,N-dimethyl-, 2',3',5'-triacetate
SpectraBase Compound ID Lv09Zii8Tt6
InChI InChI=1S/C18H24N6O7/c1-8(25)28-6-11-13(29-9(2)26)14(30-10(3)27)17(31-11)24-7-20-12-15(19)21-18(23(4)5)22-16(12)24/h7,11,13-14,17H,6H2,1-5H3,(H2,19,21,22)/t11-,13-,14-,17-/m1/s1
InChIKey RSMHZSLOZULVNT-LSCFUAHRSA-N
Mol Weight 436.43 g/mol
Molecular Formula C18H24N6O7
Exact Mass 436.170647 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID SrirCU8A6A
Name Adenosine, 2-amino-N,N-dimethyl-, 2',3',5'-triacetate
CAS Registry Number 79999-41-0
Copyright Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved.
Formula C18H24N6O7
InChI InChI=1S/C18H24N6O7/c1-8(25)28-6-11-13(29-9(2)26)14(30-10(3)27)17(31-11)24-7-20-12-15(19)21-18(23(4)5)22-16(12)24/h7,11,13-14,17H,6H2,1-5H3,(H2,19,21,22)/t11-,13-,14-,17-/m1/s1
InChIKey RSMHZSLOZULVNT-LSCFUAHRSA-N
Molecular Weight 436.425 g/mol
SMILES Nc1nc(nc2[n]([C@]3([C@@]([C@](OC(=O)C)([C@](O3)(COC(=O)C)[H])[H])(OC(=O)C)[H])[H])cnc12)N(C)C
SPLASH splash10-004r-0900500000-5f9193aedfb42760d9d6
Source of Spectrum I-59-2605-0
Synonyms 2',3',5'-tri-O-acetyl-2-N,N-dimethylaminoadenosine [(2R,3R,4R,5R)-3,4-bis(acetyloxy)-5-[6-amino-2-(dimethylamino)-9H-purin-9-yl]oxolan-2-yl]methyl acetate
Wiley ID 1383376