| Properties | Image |
|---|
| MNX_ID | MNXM65899 |
 |
| reference | keggD:D07083 |
| formula | C29H43BrN2O4 |
| global charge | 0 |
| mol weight | 563.577 |
| InChIKey | VWZPIJGXYWHBOW-UHFFFAOYSA-N |
| InChI | InChI=1S/C29H42N2O4.BrH/c1-5-8-9-10-11-14-22-34-27-16-13-12-15-26(27)28(32)30-25-19-17-24(18-20-25)29(33)35-23-21-31(4,6-2)7-3;/h12-13,15-20H,5-11,14,21-23H2,1-4H3;1H |
| SMILES | CCCCCCCCOC1=CC=CC=C1C(=O)NC1=CC=C(C(=O)OCC[N+](C)(CC)CC)C=C1.[Br-] |
MNX internals
| InChI (mnx) | InChI=1/C29H42N2O4.BrH/c1-5-8-9-10-11-14-22-34-27-16-13-12-15-26(27)28(32)30-25-19-17-24(18-20-25)29(33)35-23-21-31(4,6-2)7-3;/h12-13,15-20H,5-11,14,21-23H2,1-4H3;1H |
 |
| SMILES (mnx) | [BrH:36].[CH3:1][CH2:5][CH2:8][CH2:9][CH2:10][CH2:11][CH2:14][CH2:22][O:34][C:27]1=[CH:16][CH:13]=[CH:12][CH:15]=[C:26]1[C:28]([N:30]=[C:25]1[CH:19]=[CH:17][C:24](=[C:29]([O-:33])[O:35][CH2:23][CH2:21][N+:31]([CH3:4])([CH2:6][CH3:2])[CH2:7][CH3:3])[CH:18]=[CH:20]1)=[O:32] |
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