SpectraBase Spectrum ID |
XiJm1xxhIk |
Name |
(E)-3-[9-((2R,3R,4S,5R)-3,4-Dihydroxy-5-methyl-tetrahydro-furan-2-yl)-9H-purin-6-ylamino]-propenal |
Copyright |
Copyright © 2020-2025 John Wiley & Sons, Inc. All Rights Reserved. |
Formula |
C13H15N5O4 |
InChI |
InChI=1S/C13H15N5O4/c1-7-9(20)10(21)13(22-7)18-6-17-8-11(14-3-2-4-19)15-5-16-12(8)18/h2-7,9-10,13,20-21H,1H3,(H,14,15,16)/b3-2+/t7-,9-,10-,13-/m1/s1 |
InChIKey |
XXMIHZZZLGQZIX-VECBDBMCSA-N |
Molecular Weight |
305.294 g/mol |
SMILES |
O[C@@]1([C@](O[C@]([C@@]1(O)[H])([n]1c2c(c(ncn2)N\C=C\C=O)nc1)[H])(C)[H])[H] |
SPLASH |
splash10-03dr-0920000000-c12e8eea98245c585fac |
Source of Spectrum |
CRT-10-1181-M1A-dR |
Synonyms |
3-[2'-Deoxyribofuranosyl-N(6)-Adenosinyl]-propenal |
Wiley ID |
1709652 |