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toyocamycin
MNXM13049 is deprecated and here replaced by MNXM727965
!!! Alternative mappings exist !!!
| Properties | Image |
| MNX_ID | MNXM727965 |
 |
| reference | chebi:134606 |
| formula | C12H13N5O4 |
| global charge | 0 |
| mol weight | 291.267 |
| InChIKey | XOKJUSAYZUAMGJ-WOUKDFQISA-N |
| InChI | InChI=1S/C12H13N5O4/c13-1-5-2-17(11-7(5)10(14)15-4-16-11)12-9(20)8(19)6(3-18)21-12/h2,4,6,8-9,12,18-20H,3H2,(H2,14,15,16)/t6-,8-,9-,12-/m1/s1 |
| SMILES | N#CC1=CN([C@@H]2O[C@H](CO)[C@@H](O)[C@H]2O)C2=NC=NC(N)=C12 |
MNX internals
| InChI (mnx) | InChI=1/C12H13N5O4/c13-1-5-2-17(11-7(5)10(14)15-4-16-11)12-9(20)8(19)6(3-18)21-12/h2,4,6,8-9,12,18-20H,3H2,(H2,14,15,16)/t6-,8-,9-,12-/m1/s1 |
 |
| SMILES (mnx) | [C:1]([C:5]1=[CH:2][N:17]([C@H:12]2[C@H:9]([OH:20])[C@H:8]([OH:19])[C@@H:6]([CH2:3][OH:18])[O:21]2)[C:11]2=[C:7]1[C:10]([NH2:14])=[N:15][CH:4]=[N:16]2)#[N:13] |
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| Parent-child relations graph |
| Occurences in reactions | #reac |
| in my sandbox |
0 |
| in MNXref (generic) | 4 |
| in models (compartimentalized) |
0 |
|
Similar chemical compounds in external resources
| Identifier | Description |
CHEBI:134606 chebi:134606 XOKJUSAYZUAMGJ-WOUKDFQISA-N
| toyocamycin 4-amino-5-cyano-7-(D-ribofuranosyl)-7H-pyrrolo(2,3-d)pyrimidine 4-amino-7-beta-D-ribofuranosyl-7H-pyrrolo[2,3-d]pyrimidine-5-carbonitrile 7-deaza-7-cyanoadenosine A-399-Y4 Ahygroscopin-B Antibiotic 1037 Antibiotic A-399-Y4 Antibiotic E212 E-212 Siromycin Uramycin B Vengicide cyanotubericidin
|
seed.compound:cpd23719 seedM:cpd23719 XOKJUSAYZUAMGJ-WOUKDFQISA-N
| ahygroscopin-B antibiotic 1037 cyanotubericidin naritheracin siromycin toyocamycin toyokamycin unamycin-B uramycin B vengicide
|
metacyc.compound:CPD-13056 metacycM:CPD-13056 XOKJUSAYZUAMGJ-WOUKDFQISA-N
| toyocamycin ahygroscopin-B antibiotic 1037 cyanotubericidin naritheracin siromycin toyokamycin unamycin-B uramycin B vengicide
|
seedM:M_cpd23719
| secondary/obsolete/fantasy identifier
|