SpectraBase Spectrum ID |
KgoqQDkh4zk |
Name |
(E)/(Z)-9-{[2-(Benzyloxymethyl)-1-hydroxycyclohexyl]methyl}-N(6)-benzoyladenine |
Comments |
Less than 3 mono-isotopic peaks |
Copyright |
Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved. |
Formula |
C27H29N5O3 |
InChI |
InChI=1S/C27H29N5O3/c33-26(21-11-5-2-6-12-21)31-24-23-25(29-18-28-24)32(19-30-23)17-27(34)14-8-7-13-22(27)16-35-15-20-9-3-1-4-10-20/h1-6,9-12,18-19,22,34H,7-8,13-17H2,(H,28,29,31,33) |
InChIKey |
BOIUMIVCHBFLTD-UHFFFAOYSA-N |
Molecular Weight |
471.561 g/mol |
SMILES |
OC1(C[n]2c3c(c(ncn3)NC(=O)c3ccccc3)nc2)C(COCc2ccccc2)CCCC1 |
SPLASH |
splash10-0006-9000000000-3cac974a5067e1a5cb8e |
Source of Spectrum |
J-65-5184-49 |
Synonyms |
N-[9-({2-[(benzyloxy)methyl]-1-hydroxycyclohexyl}methyl)-9H-purin-6-yl]benzamide |
Wiley ID |
1533019 |