| Properties | Image |
|---|
| MNX_ID | MNXM185843 |
 |
| reference | slm:000014540 |
| formula | C48H82O13P |
| global charge | -1 |
| mol weight | 898.145 |
| InChIKey | QYNSXSZDTPDKPB-SUAAMZIISA-M |
| InChI | InChI=1S/C48H83O13P/c1-4-5-6-7-8-9-10-11-12-13-14-15-16-17-18-19-20-21-22-23-26-30-33-36-42(50)60-40(37-58-41(49)35-32-29-27-24-25-28-31-34-39(2)3)38-59-62(56,57)61-48-46(54)44(52)43(51)45(53)47(48)55/h5-6,8-9,11-12,14-15,17-18,39-40,43-48,51-55H,4,7,10,13,16,19-38H2,1-3H3,(H,56,57)/p-1/b6-5-,9-8-,12-11-,15-14-,18-17-/t40-,43-,44-,45+,46-,47-,48-/m1/s1 |
| SMILES | CC/C=C\C/C=C\C/C=C\C/C=C\C/C=C\CCCCCCCCCC(=O)O[C@H](COC(=O)CCCCCCCCCC(C)C)COP(=O)([O-])O[C@@H]1[C@H](O)[C@H](O)[C@@H](O)[C@H](O)[C@H]1O |
MNX internals
| InChI (mnx) | InChI=1/C48H83O13P/c1-4-5-6-7-8-9-10-11-12-13-14-15-16-17-18-19-20-21-22-23-26-30-33-36-42(50)60-40(37-58-41(49)35-32-29-27-24-25-28-31-34-39(2)3)38-59-62(56,57)61-48-46(54)44(52)43(51)45(53)47(48)55/h5-6,8-9,11-12,14-15,17-18,39-40,43-48,51-55H,4,7,10,13,16,19-38H2,1-3H3,(H,56,57)/b6-5-,9-8-,12-11-,15-14-,18-17-/t40-,43-,44-,45+,46-,47-,48-/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][CH2:26][CH2:30][CH2:33][CH2:36][C:42](=[O:50])[O:60][C@H:40]([CH2:37][O:58][C:41]([CH2:35][CH2:32][CH2:29][CH2:27][CH2:24][CH2:25][CH2:28][CH2:31][CH2:34][CH:39]([CH3:2])[CH3:3])=[O:49])[CH2:38][O:59][P:62]([OH:56])(=[O:57])[O:61][C@@H:48]1[C@H:46]([OH:54])[C@H:44]([OH:52])[C@@H:43]([OH:51])[C@H:45]([OH:53])[C@H:47]1[OH:55] |
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