| Properties | Image |
|---|
| MNX_ID | MNXM1100728 |
 |
| reference | metacycM:CPD-16456 |
| formula | C15H16N10O2 |
| global charge | 0 |
| mol weight | 368.361 |
| InChIKey | YQZKTYLJVUNTLT-UHFFFAOYSA-N |
| InChI | InChI=1S/C15H16N10O2/c1-4-7-5(2-18-10-8(20-7)12(26)23-14(16)21-10)6-3-19-11-9(25(4)6)13(27)24-15(17)22-11/h5-6H,2-3H2,1H3,(H3,16,18,21,23,26)(H4,17,19,22,24,27) |
| SMILES | CC1=C2N=C3C(=O)N=C(N)NC3=NCC2C2CNC3=C(C(=O)N=C(N)N3)N12 |
MNX internals
| InChI (mnx) | InChI=1/C15H16N10O2/c1-4-7-5(2-18-10-8(20-7)12(26)23-14(16)21-10)6-3-19-11-9(25(4)6)13(27)24-15(17)22-11/h5-6H,2-3H2,1H3,(H3,16,18,21,23,26)(H4,17,19,22,24,27)/t5?,6? |
 |
| SMILES (mnx) | [CH3:1][C:4]1=[C:7]2[CH:5]([CH2:2][N:18]=[C:10]3[C:8](=[N:20]2)[C:12]([OH:26])=[N:23][C:14](=[NH:16])[NH:21]3)[CH:6]2[CH2:3][NH:19][C:11]3=[C:9]([C:13]([OH:27])=[N:24][C:15](=[NH:17])[NH:22]3)[N:25]12 |
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