| Properties | Image |
|---|
| MNX_ID | MNXM322884 |
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| reference | slm:000490123 |
| formula | C60H103NO10P |
| global charge | -1 |
| mol weight | 1029.455 |
| InChIKey | MPVGRDZCTNAFTJ-HEHULTGWSA-M |
| InChI | InChI=1S/C60H104NO10P/c1-3-5-7-9-11-13-15-17-18-19-20-21-22-23-24-25-26-27-28-29-30-31-32-33-34-35-36-37-38-40-42-44-46-48-50-52-59(63)71-56(54-69-72(66,67)70-55-57(61)60(64)65)53-68-58(62)51-49-47-45-43-41-39-16-14-12-10-8-6-4-2/h8,10-11,13-14,16-18,20-21,23-24,26-27,56-57H,3-7,9,12,15,19,22,25,28-55,61H2,1-2H3,(H,64,65)(H,66,67)/p-1/b10-8-,13-11-,16-14-,18-17-,21-20-,24-23-,27-26-/t56-,57+/m1/s1 |
| SMILES | CCC/C=C\C/C=C\CCCCCCCC(=O)OC[C@H](COP(=O)([O-])OC[C@H]([NH3+])C(=O)[O-])OC(=O)CCCCCCCCCCCCCCCCCC/C=C\C/C=C\C/C=C\C/C=C\C/C=C\CCCCC |
MNX internals
| InChI (mnx) | InChI=1/C60H104NO10P/c1-3-5-7-9-11-13-15-17-18-19-20-21-22-23-24-25-26-27-28-29-30-31-32-33-34-35-36-37-38-40-42-44-46-48-50-52-59(63)71-56(54-69-72(66,67)70-55-57(61)60(64)65)53-68-58(62)51-49-47-45-43-41-39-16-14-12-10-8-6-4-2/h8,10-11,13-14,16-18,20-21,23-24,26-27,56-57H,3-7,9,12,15,19,22,25,28-55,61H2,1-2H3,(H,64,65)(H,66,67)/b10-8-,13-11-,16-14-,18-17-,21-20-,24-23-,27-26-/t56-,57+/m1/s1 |
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| SMILES (mnx) | [CH3:1][CH2:3][CH2:5][CH2:7][CH2:9]/[CH:11]=[CH:13]\[CH2:15]/[CH:17]=[CH:18]\[CH2:19]/[CH:20]=[CH:21]\[CH2:22]/[CH:23]=[CH:24]\[CH2:25]/[CH:26]=[CH:27]\[CH2:28][CH2:29][CH2:30][CH2:31][CH2:32][CH2:33][CH2:34][CH2:35][CH2:36][CH2:37][CH2:38][CH2:40][CH2:42][CH2:44][CH2:46][CH2:48][CH2:50][CH2:52][C:59](=[O:63])[O:71][C@H:56]([CH2:53][O:68][C:58]([CH2:51][CH2:49][CH2:47][CH2:45][CH2:43][CH2:41][CH2:39]/[CH:16]=[CH:14]\[CH2:12]/[CH:10]=[CH:8]\[CH2:6][CH2:4][CH3:2])=[O:62])[CH2:54][O:69][P:72]([OH:66])(=[O:67])[O:70][CH2:55][C@@H:57]([C:60](=[O:64])[OH:65])[NH2:61] |
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