| Properties | Image |
|---|
| MNX_ID | MNXM209683 |
 |
| reference | slm:000002075 |
| formula | C64H103NO10P |
| global charge | -1 |
| mol weight | 1077.499 |
| InChIKey | VOHHMJYPSVLMAE-QTUKYGNISA-M |
| InChI | InChI=1S/C64H104NO10P/c1-3-5-7-9-11-13-15-17-19-21-23-25-27-29-30-32-33-35-37-39-41-43-45-47-49-51-53-55-62(66)72-57-60(58-73-76(70,71)74-59-61(65)64(68)69)75-63(67)56-54-52-50-48-46-44-42-40-38-36-34-31-28-26-24-22-20-18-16-14-12-10-8-6-4-2/h5,7,11-14,17-20,23-26,29-31,33-35,38,40,60-61H,3-4,6,8-10,15-16,21-22,27-28,32,36-37,39,41-59,65H2,1-2H3,(H,68,69)(H,70,71)/p-1/b7-5-,13-11-,14-12-,19-17-,20-18-,25-23-,26-24-,30-29-,34-31-,35-33-,40-38-/t60-,61+/m1/s1 |
| SMILES | CC/C=C\C/C=C\C/C=C\C/C=C\C/C=C\C/C=C\CCCCCCCCCCC(=O)OC[C@H](COP(=O)([O-])OC[C@H]([NH3+])C(=O)[O-])OC(=O)CCCCCCCC/C=C\C/C=C\C/C=C\C/C=C\C/C=C\CCCCC |
MNX internals
| InChI (mnx) | InChI=1/C64H104NO10P/c1-3-5-7-9-11-13-15-17-19-21-23-25-27-29-30-32-33-35-37-39-41-43-45-47-49-51-53-55-62(66)72-57-60(58-73-76(70,71)74-59-61(65)64(68)69)75-63(67)56-54-52-50-48-46-44-42-40-38-36-34-31-28-26-24-22-20-18-16-14-12-10-8-6-4-2/h5,7,11-14,17-20,23-26,29-31,33-35,38,40,60-61H,3-4,6,8-10,15-16,21-22,27-28,32,36-37,39,41-59,65H2,1-2H3,(H,68,69)(H,70,71)/b7-5-,13-11-,14-12-,19-17-,20-18-,25-23-,26-24-,30-29-,34-31-,35-33-,40-38-/t60-,61+/m1/s1 |
 |
| SMILES (mnx) | [CH3:1][CH2:3]/[CH:5]=[CH:7]\[CH2:9]/[CH:11]=[CH:13]\[CH2:15]/[CH:17]=[CH:19]\[CH2:21]/[CH:23]=[CH:25]\[CH2:27]/[CH:29]=[CH:30]\[CH2:32]/[CH:33]=[CH:35]\[CH2:37][CH2:39][CH2:41][CH2:43][CH2:45][CH2:47][CH2:49][CH2:51][CH2:53][CH2:55][C:62](=[O:66])[O:72][CH2:57][C@H:60]([CH2:58][O:73][P:76]([OH:70])(=[O:71])[O:74][CH2:59][C@@H:61]([C:64](=[O:68])[OH:69])[NH2:65])[O:75][C:63]([CH2:56][CH2:54][CH2:52][CH2:50][CH2:48][CH2:46][CH2:44][CH2:42]/[CH:40]=[CH:38]\[CH2:36]/[CH:34]=[CH:31]\[CH2:28]/[CH:26]=[CH:24]\[CH2:22]/[CH:20]=[CH:18]\[CH2:16]/[CH:14]=[CH:12]\[CH2:10][CH2:8][CH2:6][CH2:4][CH3:2])=[O:67] |
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