| Properties | Image |
| MNX_ID | MNXM1594278 |
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| reference | vmhM:dnpz_m7 vmhM:dnpz_m7 |
| formula | C23H28NO4 |
| global charge | 1 |
| mol weight | 382.48 |
| InChIKey | ADGOGAGDSXYFTG-UHFFFAOYSA-O |
| InChI | InChI=1S/C23H27NO4/c1-28-22-13-20-17(12-21(22)26)11-18(23(20)27)10-15-6-8-24(9-7-15)14-16-2-4-19(25)5-3-16/h2-5,12-13,15,18,25-26H,6-11,14H2,1H3/p+1 |
| SMILES | COc1cc2c(cc1O)CC(CC1CC[NH+](Cc3ccc(O)cc3)CC1)C2=O |
MNX internals
| InChI (mnx) | InChI=1/C23H27NO4/c1-28-22-13-20-17(12-21(22)26)11-18(23(20)27)10-15-6-8-24(9-7-15)14-16-2-4-19(25)5-3-16/h2-5,12-13,15,18,25-26H,6-11,14H2,1H3/t18? |
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| SMILES (mnx) | [CH3:1][O:28][c:22]1[cH:13][c:20]2[c:17]([cH:12][c:21]1[OH:26])[CH2:11][CH:18]([CH2:10][CH:15]1[CH2:6][CH2:8][N:24]([CH2:14][c:16]3[cH:2][cH:4][c:19]([OH:25])[cH:5][cH:3]3)[CH2:9][CH2:7]1)[C:23]2=[O:27] |
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