| Properties | Image |
MNX_ID | MNXM342922 |
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reference | slm:000475682 |
formula | C24H41O13P2 |
global charge | -3 |
mol weight | 599.527 |
InChIKey | OXLIOIVHIYFDQD-NUROEKIBSA-K |
InChI | InChI=1S/C24H44O13P2/c1-3-4-5-6-7-8-9-10-11-12-13-14-15-16-24(27)37-23(19-33-21(2)25)20-36-39(31,32)35-18-22(26)17-34-38(28,29)30/h5-6,8-9,22-23,26H,3-4,7,10-20H2,1-2H3,(H,31,32)(H2,28,29,30)/p-3/b6-5-,9-8-/t22-,23+/m0/s1 |
SMILES | CCC/C=C\C/C=C\CCCCCCCC(=O)O[C@H](COC(C)=O)COP(=O)([O-])OC[C@@H](O)COP(=O)([O-])[O-] |
MNX internals
InChI (mnx) | InChI=1/C24H44O13P2/c1-3-4-5-6-7-8-9-10-11-12-13-14-15-16-24(27)37-23(19-33-21(2)25)20-36-39(31,32)35-18-22(26)17-34-38(28,29)30/h5-6,8-9,22-23,26H,3-4,7,10-20H2,1-2H3,(H,31,32)(H2,28,29,30)/b6-5-,9-8-/t22-,23+/m0/s1 |
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SMILES (mnx) | [CH3:1][CH2:3][CH2:4]/[CH:5]=[CH:6]\[CH2:7]/[CH:8]=[CH:9]\[CH2:10][CH2:11][CH2:12][CH2:13][CH2:14][CH2:15][CH2:16][C:24](=[O:27])[O:37][C@H:23]([CH2:19][O:33][C:21]([CH3:2])=[O:25])[CH2:20][O:36][P:39]([OH:31])(=[O:32])[O:35][CH2:18][C@H:22]([CH2:17][O:34][P:38]([OH:28])([OH:29])=[O:30])[OH:26] |
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