| Properties | Image |
|---|
| MNX_ID | MNXM106942 |
 |
| reference | chebi:70890 |
| formula | C40H81N2O7P |
| global charge | 0 |
| mol weight | 733.069 |
| InChIKey | LPSAVWCDKGBKCC-JORKQJRBSA-N |
| InChI | InChI=1S/C40H81N2O7P/c1-7-8-9-10-11-12-13-14-15-16-19-23-26-29-32-39(44)40(45)41-37(35-49-50(46,47)48-34-33-42(4,5)6)38(43)31-28-25-22-20-17-18-21-24-27-30-36(2)3/h28,31,36-39,43-44H,7-27,29-30,32-35H2,1-6H3,(H-,41,45,46,47)/b31-28+/t37-,38+,39?/m0/s1 |
| SMILES | CCCCCCCCCCCCCCCCC(O)C(=O)N[C@@H](COP(=O)([O-])OCC[N+](C)(C)C)[C@H](O)/C=C/CCCCCCCCCC(C)C |
MNX internals
| InChI (mnx) | InChI=1/C40H81N2O7P/c1-7-8-9-10-11-12-13-14-15-16-19-23-26-29-32-39(44)40(45)41-37(35-49-50(46,47)48-34-33-42(4,5)6)38(43)31-28-25-22-20-17-18-21-24-27-30-36(2)3/h28,31,36-39,43-44H,7-27,29-30,32-35H2,1-6H3,(H-,41,45,46,47)/b31-28+/t37-,38+,39?/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][CH2:19][CH2:23][CH2:26][CH2:29][CH2:32][CH:39]([C:40](=[N:41][C@@H:37]([CH2:35][O:49][P:50]([O-:46])(=[O:47])[O:48][CH2:34][CH2:33][N+:42]([CH3:4])([CH3:5])[CH3:6])[C@@H:38](/[CH:31]=[CH:28]/[CH2:25][CH2:22][CH2:20][CH2:17][CH2:18][CH2:21][CH2:24][CH2:27][CH2:30][CH:36]([CH3:2])[CH3:3])[OH:43])[OH:45])[OH:44] |
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