| Properties | Image |
|---|
| MNX_ID | MNXM344040 |
 |
| reference | slm:000019084 |
| formula | C35H58O13P |
| global charge | -1 |
| mol weight | 717.81 |
| InChIKey | HQQZVYBRHMAUPM-AHXQJCKGSA-M |
| InChI | InChI=1S/C35H59O13P/c1-3-5-6-7-8-9-10-11-12-13-14-15-16-17-18-19-20-21-22-24-29(37)47-27(25-45-28(36)23-4-2)26-46-49(43,44)48-35-33(41)31(39)30(38)32(40)34(35)42/h8-9,11-12,14-15,17-18,27,30-35,38-42H,3-7,10,13,16,19-26H2,1-2H3,(H,43,44)/p-1/b9-8-,12-11-,15-14-,18-17-/t27-,30-,31-,32+,33-,34-,35-/m1/s1 |
| SMILES | CCCCC/C=C\C/C=C\C/C=C\C/C=C\CCCCCC(=O)O[C@H](COC(=O)CCC)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/C35H59O13P/c1-3-5-6-7-8-9-10-11-12-13-14-15-16-17-18-19-20-21-22-24-29(37)47-27(25-45-28(36)23-4-2)26-46-49(43,44)48-35-33(41)31(39)30(38)32(40)34(35)42/h8-9,11-12,14-15,17-18,27,30-35,38-42H,3-7,10,13,16,19-26H2,1-2H3,(H,43,44)/b9-8-,12-11-,15-14-,18-17-/t27-,30-,31-,32+,33-,34-,35-/m1/s1 |
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| SMILES (mnx) | [CH3:1][CH2:3][CH2:5][CH2:6][CH2:7]/[CH:8]=[CH:9]\[CH2:10]/[CH:11]=[CH:12]\[CH2:13]/[CH:14]=[CH:15]\[CH2:16]/[CH:17]=[CH:18]\[CH2:19][CH2:20][CH2:21][CH2:22][CH2:24][C:29](=[O:37])[O:47][C@H:27]([CH2:25][O:45][C:28]([CH2:23][CH2:4][CH3:2])=[O:36])[CH2:26][O:46][P:49]([OH:43])(=[O:44])[O:48][C@@H:35]1[C@H:33]([OH:41])[C@H:31]([OH:39])[C@@H:30]([OH:38])[C@H:32]([OH:40])[C@H:34]1[OH:42] |
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