| Properties | Image |
| MNX_ID | MNXM107000 |
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| reference | chebi:69735 |
| formula | C13H17NO3 |
| global charge | 0 |
| mol weight | 235.283 |
| InChIKey | RTRPDDKCVKBLPF-UHFFFAOYSA-N |
| InChI | InChI=1S/C13H17NO3/c1-9(2)7-13(17)14-8-12(16)10-3-5-11(15)6-4-10/h3-6,9,15H,7-8H2,1-2H3,(H,14,17) |
| SMILES | CC(C)CC(=O)NCC(=O)C1=CC=C(O)C=C1 |
MNX internals
| InChI (mnx) | InChI=1/C13H17NO3/c1-9(2)7-13(17)14-8-12(16)10-3-5-11(15)6-4-10/h3-6,9,15H,7-8H2,1-2H3,(H,14,17) |
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| SMILES (mnx) | [CH3:1][CH:9]([CH3:2])[CH2:7][C:13](=[N:14][CH2:8][C:12]([C:10]1=[CH:4][CH:6]=[C:11]([OH:15])[CH:5]=[CH:3]1)=[O:16])[OH:17] |
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