| Properties | Image |
|---|
| MNX_ID | MNXM213062 |
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| reference | slm:000439948 |
| formula | C58H99O22P4 |
| global charge | -7 |
| mol weight | 1272.304 |
| InChIKey | OMSISOQNNVZUPE-RSUKBLNNSA-G |
| InChI | InChI=1S/C58H106O22P4/c1-4-5-6-7-8-9-10-11-12-13-14-15-16-17-18-19-20-21-22-23-24-25-26-27-28-29-30-33-37-40-43-46-52(60)76-50(47-74-51(59)45-42-39-36-34-31-32-35-38-41-44-49(2)3)48-75-84(72,73)80-55-53(61)56(77-81(63,64)65)58(79-83(69,70)71)57(54(55)62)78-82(66,67)68/h5-6,8-9,11-12,14-15,17-18,49-50,53-58,61-62H,4,7,10,13,16,19-48H2,1-3H3,(H,72,73)(H2,63,64,65)(H2,66,67,68)(H2,69,70,71)/p-7/b6-5-,9-8-,12-11-,15-14-,18-17-/t50-,53+,54+,55-,56+,57-,58-/m1/s1 |
| SMILES | CC/C=C\C/C=C\C/C=C\C/C=C\C/C=C\CCCCCCCCCCCCCCCCCC(=O)O[C@H](COC(=O)CCCCCCCCCCCC(C)C)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 |
MNX internals
| InChI (mnx) | InChI=1/C58H106O22P4/c1-4-5-6-7-8-9-10-11-12-13-14-15-16-17-18-19-20-21-22-23-24-25-26-27-28-29-30-33-37-40-43-46-52(60)76-50(47-74-51(59)45-42-39-36-34-31-32-35-38-41-44-49(2)3)48-75-84(72,73)80-55-53(61)56(77-81(63,64)65)58(79-83(69,70)71)57(54(55)62)78-82(66,67)68/h5-6,8-9,11-12,14-15,17-18,49-50,53-58,61-62H,4,7,10,13,16,19-48H2,1-3H3,(H,72,73)(H2,63,64,65)(H2,66,67,68)(H2,69,70,71)/b6-5-,9-8-,12-11-,15-14-,18-17-/t50-,53+,54+,55-,56+,57-,58-/m1/s1 |
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| SMILES (mnx) | [CH3:1][CH2:4]/[CH:5]=[CH: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][CH2:23][CH2:24][CH2:25][CH2:26][CH2:27][CH2:28][CH2:29][CH2:30][CH2:33][CH2:37][CH2:40][CH2:43][CH2:46][C:52](=[O:60])[O:76][C@H:50]([CH2:47][O:74][C:51]([CH2:45][CH2:42][CH2:39][CH2:36][CH2:34][CH2:31][CH2:32][CH2:35][CH2:38][CH2:41][CH2:44][CH:49]([CH3:2])[CH3:3])=[O:59])[CH2:48][O:75][P:84]([OH:72])(=[O:73])[O:80][C@@H:55]1[C@H:53]([OH:61])[C@H:56]([O:77][P:81]([OH:63])([OH:64])=[O:65])[C@@H:58]([O:79][P:83]([OH:69])([OH:70])=[O:71])[C@H:57]([O:78][P:82]([OH:66])([OH:67])=[O:68])[C@H:54]1[OH:62] |
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