| Properties | Image |
|---|
| MNX_ID | MNXM953282 |
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| reference | slm:000645667 |
| formula | C59H99NO9P |
| global charge | -1 |
| mol weight | 997.413 |
| InChIKey | WJGZTUNTUBRWGV-HTUNTXKWSA-M |
| InChI | InChI=1S/C59H100NO9P/c1-4-7-10-13-16-19-21-23-25-27-28-30-32-34-36-39-42-45-48-51-59(63)69-56(55-68-70(64,65)67-53-52-60-57(61)49-46-43-40-37-18-15-12-9-6-3)54-66-58(62)50-47-44-41-38-35-33-31-29-26-24-22-20-17-14-11-8-5-2/h7,10,16-17,19-20,23-26,28,30,34,36,42,45,56H,4-6,8-9,11-15,18,21-22,27,29,31-33,35,37-41,43-44,46-55H2,1-3H3,(H,60,61)(H,64,65)/p-1/b10-7-,19-16-,20-17-,25-23-,26-24-,30-28-,36-34-,45-42-/t56-/m1/s1 |
| SMILES | CC/C=C\C/C=C\C/C=C\C/C=C\C/C=C\C/C=C\CCC(=O)O[C@H](COC(=O)CCCCCCCCC/C=C\C/C=C\CCCCC)COP(=O)([O-])OCCNC(=O)CCCCCCCCCCC |
MNX internals
| InChI (mnx) | InChI=1/C59H100NO9P/c1-4-7-10-13-16-19-21-23-25-27-28-30-32-34-36-39-42-45-48-51-59(63)69-56(55-68-70(64,65)67-53-52-60-57(61)49-46-43-40-37-18-15-12-9-6-3)54-66-58(62)50-47-44-41-38-35-33-31-29-26-24-22-20-17-14-11-8-5-2/h7,10,16-17,19-20,23-26,28,30,34,36,42,45,56H,4-6,8-9,11-15,18,21-22,27,29,31-33,35,37-41,43-44,46-55H2,1-3H3,(H,60,61)(H,64,65)/b10-7-,19-16-,20-17-,25-23-,26-24-,30-28-,36-34-,45-42-/t56-/m1/s1 |
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| SMILES (mnx) | [CH3:1][CH2:4]/[CH:7]=[CH:10]\[CH2:13]/[CH:16]=[CH:19]\[CH2:21]/[CH:23]=[CH:25]\[CH2:27]/[CH:28]=[CH:30]\[CH2:32]/[CH:34]=[CH:36]\[CH2:39]/[CH:42]=[CH:45]\[CH2:48][CH2:51][C:59](=[O:63])[O:69][C@H:56]([CH2:54][O:66][C:58]([CH2:50][CH2:47][CH2:44][CH2:41][CH2:38][CH2:35][CH2:33][CH2:31][CH2:29]/[CH:26]=[CH:24]\[CH2:22]/[CH:20]=[CH:17]\[CH2:14][CH2:11][CH2:8][CH2:5][CH3:2])=[O:62])[CH2:55][O:68][P:70]([OH:64])(=[O:65])[O:67][CH2:53][CH2:52][N:60]=[C:57]([CH2:49][CH2:46][CH2:43][CH2:40][CH2:37][CH2:18][CH2:15][CH2:12][CH2:9][CH2:6][CH3:3])[OH:61] |
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