| Properties | Image |
| MNX_ID | MNXM147655 |
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| reference | metacycM:CPD-15801 |
| formula | C19H24NO4 |
| global charge | 1 |
| mol weight | 330.404 |
| InChIKey | FUTZESSLBXJDFG-HNNXBMFYSA-O |
| InChI | InChI=1S/C19H23NO4/c1-22-17-9-12(4-5-16(17)21)8-15-14-11-19(24-3)18(23-2)10-13(14)6-7-20-15/h4-5,9-11,15,20-21H,6-8H2,1-3H3/p+1/t15-/m0/s1 |
| SMILES | COC1=CC(C[C@@H]2[NH2+]CCC3=C2C=C(OC)C(OC)=C3)=CC=C1O |
MNX internals
| InChI (mnx) | InChI=1/C19H23NO4/c1-22-17-9-12(4-5-16(17)21)8-15-14-11-19(24-3)18(23-2)10-13(14)6-7-20-15/h4-5,9-11,15,20-21H,6-8H2,1-3H3/t15-/m0/s1 |
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| SMILES (mnx) | [CH3:1][O:22][C:17]1=[C:16]([OH:21])[CH:5]=[CH:4][C:12]([CH2:8][C@H:15]2[C:14]3=[CH:11][C:19]([O:24][CH3:3])=[C:18]([O:23][CH3:2])[CH:10]=[C:13]3[CH2:6][CH2:7][NH:20]2)=[CH:9]1 |
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