| Properties | Image |
|---|
| MNX_ID | MNXM344784 |
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| reference | slm:000443797 |
| formula | C32H57O22P4 |
| global charge | -7 |
| mol weight | 917.682 |
| InChIKey | JHDFQKYOENJCPU-CHCNVJGASA-G |
| InChI | InChI=1S/C32H64O22P4/c1-4-5-6-7-9-13-16-19-25(33)48-21-24(50-26(34)20-17-14-11-8-10-12-15-18-23(2)3)22-49-58(46,47)54-29-27(35)30(51-55(37,38)39)32(53-57(43,44)45)31(28(29)36)52-56(40,41)42/h23-24,27-32,35-36H,4-22H2,1-3H3,(H,46,47)(H2,37,38,39)(H2,40,41,42)(H2,43,44,45)/p-7/t24-,27+,28+,29-,30+,31-,32-/m1/s1 |
| SMILES | CCCCCCCCCC(=O)OC[C@H](COP(=O)([O-])O[C@H]1[C@H](O)[C@@H](OP(=O)([O-])[O-])[C@H](OP(=O)([O-])[O-])[C@@H](OP(=O)([O-])[O-])[C@H]1O)OC(=O)CCCCCCCCCC(C)C |
MNX internals
| InChI (mnx) | InChI=1/C32H64O22P4/c1-4-5-6-7-9-13-16-19-25(33)48-21-24(50-26(34)20-17-14-11-8-10-12-15-18-23(2)3)22-49-58(46,47)54-29-27(35)30(51-55(37,38)39)32(53-57(43,44)45)31(28(29)36)52-56(40,41)42/h23-24,27-32,35-36H,4-22H2,1-3H3,(H,46,47)(H2,37,38,39)(H2,40,41,42)(H2,43,44,45)/t24-,27+,28+,29-,30+,31-,32-/m1/s1 |
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| SMILES (mnx) | [CH3:1][CH2:4][CH2:5][CH2:6][CH2:7][CH2:9][CH2:13][CH2:16][CH2:19][C:25](=[O:33])[O:48][CH2:21][C@H:24]([CH2:22][O:49][P:58]([OH:46])(=[O:47])[O:54][C@@H:29]1[C@H:27]([OH:35])[C@H:30]([O:51][P:55]([OH:37])([OH:38])=[O:39])[C@@H:32]([O:53][P:57]([OH:43])([OH:44])=[O:45])[C@H:31]([O:52][P:56]([OH:40])([OH:41])=[O:42])[C@H:28]1[OH:36])[O:50][C:26]([CH2:20][CH2:17][CH2:14][CH2:11][CH2:8][CH2:10][CH2:12][CH2:15][CH2:18][CH:23]([CH3:2])[CH3:3])=[O:34] |
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