SpectraBase Spectrum ID |
DZft7RJBBLv |
Name |
1-Adenine-5-ribofuranosyl 2-Butenoate |
Copyright |
Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved. |
Formula |
C14H17N5O5 |
InChI |
InChI=1S/C14H17N5O5/c1-2-3-8(20)23-4-7-10(21)11(22)14(24-7)19-6-18-13-9(19)12(15)16-5-17-13/h2-3,5-7,10-11,14,21-22H,4H2,1H3,(H2,15,16,17)/b3-2+/t7-,10-,11-,14?/m1/s1 |
InChIKey |
BNVPJHCDTIKOQU-RUWRMQQYSA-N |
Molecular Weight |
335.320 g/mol |
SMILES |
O[C@@]1([C@](OC([C@@]1(O)[H])[n]1c2c(ncnc2N)nc1)(COC(\C=C\C)=O)[H])[H] |
SPLASH |
splash10-014i-9600000000-297ab90ff35133fefdef |
Source of Spectrum |
J-58-660-7 |
Synonyms |
(E)-But-2-enoic acid (2R,3S,4R)-5-(6-amino-purin-7-yl)-3,4-dihydroxy-tetrahydro-furan-2-ylmethyl ester
[(2R,3S,4R)-5-(6-amino-7H-purin-7-yl)-3,4-dihydroxyoxolan-2-yl]methyl (2E)-but-2-enoate |
Wiley ID |
1331537 |