| Properties | Image |
| MNX_ID | MNXM171639 |
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| reference | chebi:102709 |
| formula | C16H23N3O3 |
| global charge | 0 |
| mol weight | 305.378 |
| InChIKey | MRYDESPSWZCGBB-AZHAFVHUSA-N |
| InChI | InChI=1S/C16H23N3O3/c1-3-7-17-16(22)15-11(9-20)10-8-19-12(14(10)18(15)2)5-4-6-13(19)21/h4-6,10-11,14-15,20H,3,7-9H2,1-2H3,(H,17,22)/t10-,11-,14+,15-/m0/s1 |
| SMILES | CCCNC(=O)[C@@H]1[C@@H](CO)[C@@H]2CN3C(=O)C=CC=C3[C@@H]2N1C |
MNX internals
| InChI (mnx) | InChI=1/C16H23N3O3/c1-3-7-17-16(22)15-11(9-20)10-8-19-12(14(10)18(15)2)5-4-6-13(19)21/h4-6,10-11,14-15,20H,3,7-9H2,1-2H3,(H,17,22)/t10-,11-,14+,15-/m0/s1 |
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| SMILES (mnx) | [CH3:1][CH2:3][CH2:7][N:17]=[C:16]([C@@H:15]1[C@@H:11]([CH2:9][OH:20])[C@@H:10]2[CH2:8][N:19]3[C:12](=[CH:5][CH:4]=[CH:6][C:13]3=[O:21])[C@@H:14]2[N:18]1[CH3:2])[OH:22] |
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