| Properties | Image |
|---|
| MNX_ID | MNXM5720 |
 |
| reference | chebi:80498 |
| formula | C15H23N5O5 |
| global charge | 0 |
| mol weight | 353.379 |
| InChIKey | DBVVQDGIJAUEAZ-YXYADJKSSA-N |
| InChI | InChI=1S/C15H23N5O5/c1-8(4-21)2-3-16-13-10-14(18-6-17-13)20(7-19-10)15-12(24)11(23)9(5-22)25-15/h6-9,11-12,15,21-24H,2-5H2,1H3,(H,16,17,18)/t8?,9-,11-,12-,15-/m1/s1 |
| SMILES | CC(CO)CCNC1=NC=NC2=C1N=CN2[C@@H]1O[C@H](CO)[C@@H](O)[C@H]1O |
MNX internals
| InChI (mnx) | InChI=1/C15H23N5O5/c1-8(4-21)2-3-16-13-10-14(18-6-17-13)20(7-19-10)15-12(24)11(23)9(5-22)25-15/h6-9,11-12,15,21-24H,2-5H2,1H3,(H,16,17,18)/t8?,9-,11-,12-,15-/m1/s1 |
 |
| SMILES (mnx) | [CH3:1][CH:8]([CH2:2][CH2:3][NH:16][C:13]1=[C:10]2[C:14](=[N:18][CH:6]=[N:17]1)[N:20]([C@H:15]1[C@H:12]([OH:24])[C@H:11]([OH:23])[C@@H:9]([CH2:5][OH:22])[O:25]1)[CH:7]=[N:19]2)[CH2:4][OH:21] |
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