| Properties | Image |
|---|
| MNX_ID | MNXM360501 |
 |
| reference | slm:000019530 |
| formula | C48H90O13P |
| global charge | -1 |
| mol weight | 906.209 |
| InChIKey | CHUGXWVTLPYNPN-XXEFZXEWSA-M |
| InChI | InChI=1S/C48H91O13P/c1-3-5-7-9-11-13-15-17-19-20-21-22-23-25-27-29-31-33-35-37-42(50)60-40(39-59-62(56,57)61-48-46(54)44(52)43(51)45(53)47(48)55)38-58-41(49)36-34-32-30-28-26-24-18-16-14-12-10-8-6-4-2/h17,19,40,43-48,51-55H,3-16,18,20-39H2,1-2H3,(H,56,57)/p-1/b19-17-/t40-,43-,44-,45+,46-,47-,48-/m1/s1 |
| SMILES | CCCCCCCC/C=C\CCCCCCCCCCCC(=O)O[C@H](COC(=O)CCCCCCCCCCCCCCCC)COP(=O)([O-])O[C@@H]1[C@H](O)[C@H](O)[C@@H](O)[C@H](O)[C@H]1O |
MNX internals
| InChI (mnx) | InChI=1/C48H91O13P/c1-3-5-7-9-11-13-15-17-19-20-21-22-23-25-27-29-31-33-35-37-42(50)60-40(39-59-62(56,57)61-48-46(54)44(52)43(51)45(53)47(48)55)38-58-41(49)36-34-32-30-28-26-24-18-16-14-12-10-8-6-4-2/h17,19,40,43-48,51-55H,3-16,18,20-39H2,1-2H3,(H,56,57)/b19-17-/t40-,43-,44-,45+,46-,47-,48-/m1/s1 |
 |
| SMILES (mnx) | [CH3:1][CH2:3][CH2:5][CH2:7][CH2:9][CH2:11][CH2:13][CH2:15]/[CH:17]=[CH:19]\[CH2:20][CH2:21][CH2:22][CH2:23][CH2:25][CH2:27][CH2:29][CH2:31][CH2:33][CH2:35][CH2:37][C:42](=[O:50])[O:60][C@H:40]([CH2:38][O:58][C:41]([CH2:36][CH2:34][CH2:32][CH2:30][CH2:28][CH2:26][CH2:24][CH2:18][CH2:16][CH2:14][CH2:12][CH2:10][CH2:8][CH2:6][CH2:4][CH3:2])=[O:49])[CH2:39][O:59][P:62]([OH:56])(=[O:57])[O:61][C@@H:48]1[C@H:46]([OH:54])[C@H:44]([OH:52])[C@@H:43]([OH:51])[C@H:45]([OH:53])[C@H:47]1[OH:55] |
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