| Properties | Image | with InChI numbering | Occurences in reactions |
MNX_ID | MNXM5930 |
 |
 |
| #reac |
in my sandbox |
0 |
in MNXref (generic) | 16 |
in models (compartimentalized) |
24 |
|
formula | C28H60N3O6P |
charge | 2 |
mass | 565.776 |
reference | biggM:sphmyln_hs |
InChIKey | CSURBFNJGNBURS-AHHYHCMUSA-P |
InChI | InChI=1S/C28H58N3O6P/c1-8-9-10-11-12-13-14-15-16-17-18-19-20-21-27(32)26(29-28(33)24-31(5,6)7)25-37-38(34,35)36-23-22-30(2,3)4/h20-21,26-27,32H,8-19,22-25H2,1-7H3/p+2/b21-20+/t26-,27+/m0/s1 |
SMILES | [CH3:1][CH2:8][CH2:9][CH2:10][CH2:11][CH2:12][CH2:13][CH2:14][CH2:15][CH2:16][CH2:17][CH2:18][CH2:19]/[CH:20]=[CH:21]/[C@H:27]([C@H:26]([CH2:25][O:37][P:38](=[O:34])([O-:35])[O:36][CH2:23][CH2:22][N+:30]([CH3:2])([CH3:3])[CH3:4])[N:29]=[C:28]([CH2:24][N+:31]([CH3:5])([CH3:6])[CH3:7])[O-:33])[OH:32] |
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