SpectraBase Spectrum ID |
CSJzqD4Cre8 |
Name |
.beta.-DL-threo-Pentopyranoside, methyl 3,4-dideoxy-3-[6-methyl-4-[(phenylmethyl)amino]-7H-pyrrolo[2,3-d]pyri midin-7-yl]- |
CAS Registry Number |
88095-13-0 |
Comments |
Less than 3 mono-isotopic peaks |
Copyright |
Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved. |
Formula |
C20H24N4O3 |
InChI |
InChI=1S/C20H24N4O3/c1-13-8-16-18(21-10-14-6-4-3-5-7-14)22-12-23-19(16)24(13)17-9-15(25)11-27-20(17)26-2/h3-8,12,15,17,20,25H,9-11H2,1-2H3,(H,21,22,23)/t15?,17-,20+/m1/s1 |
InChIKey |
SZZMDPUYGSQPOE-DFWLKAPTSA-N |
Molecular Weight |
368.437 g/mol |
SMILES |
N(c1c2c([n]([C@]3([C@](OCC(C3)O)(OC)[H])[H])c(c2)C)ncn1)Cc1ccccc1 |
SPLASH |
splash10-000i-0092000000-06ec96692c1236ed6c81 |
Source of Spectrum |
Y-20-927-0 |
Synonyms |
3,4'-Didesoxy-1'-O-methyl-7-(.beta.-D,l-threo-3'-pentopyranosyl)-4-4-(benzylamino)-6-methyl-7-(2'-methoxy-3'-hydroxy-1'-oxa)cyclohexyl-6-methylpyrrolo[2,3-d]pyrimidine (isomer a)
3,4'-Didesoxy-1'-O-methyl-7-(.beta.-D,l-threo-3'-pentopyranosyl)-4-4-(benzylamino)-6-methyl-7-(2'-methoxy-3'-hydroxy-1'-oxa)cyclohexyl-6-methylpyrrolo[2,3-d]pyrimidine (isomer b)
4-Benzylamino-6-methyl-7-(2'-methoxy-3'-hydroxy-1'-oxa)cyclohexyl pyrrolo[2,3-a]pyrimidine
7H-pyrrolo[2,3-d]pyrimidine, .beta.-DL-threo-pentopyranoside deriv.
methyl 2-[4-(benzylamino)-6-methyl-7H-pyrrolo[2,3-d]pyrimidin-7-yl]-2,3-dideoxy-.alpha.-D-glycero-pentopyranoside |
Wiley ID |
1353005 |