| Properties | Image |
|---|
| MNX_ID | MNXM106871 |
 |
| reference | chebi:70927 |
| formula | C44H91N2O8P |
| global charge | 0 |
| mol weight | 807.192 |
| InChIKey | NAWGMTUIXJVSKX-YIWOKQJZSA-N |
| InChI | InChI=1S/C44H91N2O8P/c1-7-8-9-10-11-12-13-14-15-16-17-18-19-20-21-26-29-32-35-42(48)44(50)45-40(38-54-55(51,52)53-37-36-46(4,5)6)43(49)41(47)34-31-28-25-23-22-24-27-30-33-39(2)3/h39-43,47-49H,7-38H2,1-6H3,(H-,45,50,51,52)/t40-,41+,42?,43-/m0/s1 |
| SMILES | CCCCCCCCCCCCCCCCCCCCC(O)C(=O)N[C@@H](COP(=O)([O-])OCC[N+](C)(C)C)[C@H](O)[C@H](O)CCCCCCCCCCC(C)C |
MNX internals
| InChI (mnx) | InChI=1/C44H91N2O8P/c1-7-8-9-10-11-12-13-14-15-16-17-18-19-20-21-26-29-32-35-42(48)44(50)45-40(38-54-55(51,52)53-37-36-46(4,5)6)43(49)41(47)34-31-28-25-23-22-24-27-30-33-39(2)3/h39-43,47-49H,7-38H2,1-6H3,(H-,45,50,51,52)/t40-,41+,42?,43-/m0/s1 |
 |
| SMILES (mnx) | [CH3:1][CH2:7][CH2:8][CH2:9][CH2:10][CH2:11][CH2:12][CH2:13][CH2:14][CH2:15][CH2:16][CH2:17][CH2:18][CH2:19][CH2:20][CH2:21][CH2:26][CH2:29][CH2:32][CH2:35][CH:42]([C:44](=[N:45][C@@H:40]([CH2:38][O:54][P:55]([O-:51])(=[O:52])[O:53][CH2:37][CH2:36][N+:46]([CH3:4])([CH3:5])[CH3:6])[C@@H:43]([C@@H:41]([CH2:34][CH2:31][CH2:28][CH2:25][CH2:23][CH2:22][CH2:24][CH2:27][CH2:30][CH2:33][CH:39]([CH3:2])[CH3:3])[OH:47])[OH:49])[OH:50])[OH:48] |
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