| Properties | Image | with InChI numbering | Occurences in reactions |
MNX_ID | MNXM9222 |
 |
 |
| #reac |
in my sandbox |
0 |
in MNXref (generic) | 3 |
in models (compartimentalized) |
4 |
|
formula | C25H47NO4 |
charge | 0 |
mass | 425.654 |
reference | biggM:vacccrn |
InChIKey | HOAMADDCQBUDDY-ZHACJKMWSA-N |
InChI | InChI=1S/C25H47NO4/c1-5-6-7-8-9-10-11-12-13-14-15-16-17-18-19-20-25(29)30-23(21-24(27)28)22-26(2,3)4/h10-11,23H,5-9,12-22H2,1-4H3/b11-10+ |
SMILES | [CH3:1][CH2:5][CH2:6][CH2:7][CH2:8][CH2:9]/[CH:10]=[CH:11]/[CH2:12][CH2:13][CH2:14][CH2:15][CH2:16][CH2:17][CH2:18][CH2:19][CH2:20][C:25](=[O:29])[O:30][CH:23]([CH2:21][C:24](=[O:27])[O-:28])[CH2:22][N+:26]([CH3:2])([CH3:3])[CH3:4] |
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