| Properties | Image |
|---|
| MNX_ID | MNXM953532 |
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| reference | slm:000645917 |
| formula | C59H103NO9P |
| global charge | -1 |
| mol weight | 1001.445 |
| InChIKey | BIEQOCWWUBSHBR-JZQJHVBXSA-M |
| InChI | InChI=1S/C59H104NO9P/c1-4-7-10-13-15-17-19-21-23-25-26-27-28-29-30-32-34-36-38-40-42-45-48-51-59(63)69-56(55-68-70(64,65)67-53-52-60-57(61)49-46-43-12-9-6-3)54-66-58(62)50-47-44-41-39-37-35-33-31-24-22-20-18-16-14-11-8-5-2/h15-18,21-24,26-27,29-30,56H,4-14,19-20,25,28,31-55H2,1-3H3,(H,60,61)(H,64,65)/p-1/b17-15-,18-16-,23-21-,24-22-,27-26-,30-29-/t56-/m1/s1 |
| SMILES | CCCCC/C=C\C/C=C\C/C=C\C/C=C\CCCCCCCCCC(=O)O[C@H](COC(=O)CCCCCCCCC/C=C\C/C=C\CCCCC)COP(=O)([O-])OCCNC(=O)CCCCCCC |
MNX internals
| InChI (mnx) | InChI=1/C59H104NO9P/c1-4-7-10-13-15-17-19-21-23-25-26-27-28-29-30-32-34-36-38-40-42-45-48-51-59(63)69-56(55-68-70(64,65)67-53-52-60-57(61)49-46-43-12-9-6-3)54-66-58(62)50-47-44-41-39-37-35-33-31-24-22-20-18-16-14-11-8-5-2/h15-18,21-24,26-27,29-30,56H,4-14,19-20,25,28,31-55H2,1-3H3,(H,60,61)(H,64,65)/b17-15-,18-16-,23-21-,24-22-,27-26-,30-29-/t56-/m1/s1 |
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| SMILES (mnx) | [CH3:1][CH2:4][CH2:7][CH2:10][CH2:13]/[CH:15]=[CH:17]\[CH2:19]/[CH:21]=[CH:23]\[CH2:25]/[CH:26]=[CH:27]\[CH2:28]/[CH:29]=[CH:30]\[CH2:32][CH2:34][CH2:36][CH2:38][CH2:40][CH2:42][CH2:45][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][CH2:39][CH2:37][CH2:35][CH2:33][CH2:31]/[CH:24]=[CH:22]\[CH2:20]/[CH:18]=[CH:16]\[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][CH2:12][CH2:9][CH2:6][CH3:3])[OH:61] |
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