| Properties | Image |
|---|
| MNX_ID | MNXM342558 |
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| reference | slm:000475657 |
| formula | C42H73O13P2 |
| global charge | -3 |
| mol weight | 847.981 |
| InChIKey | BWWPJLBNFHNEID-IFNSPZSWSA-K |
| InChI | InChI=1S/C42H76O13P2/c1-3-4-5-6-7-8-9-10-11-12-13-14-15-16-17-18-19-20-21-22-23-24-25-26-27-28-29-30-31-32-33-34-42(45)55-41(37-51-39(2)43)38-54-57(49,50)53-36-40(44)35-52-56(46,47)48/h7-8,10-11,13-14,16-17,40-41,44H,3-6,9,12,15,18-38H2,1-2H3,(H,49,50)(H2,46,47,48)/p-3/b8-7-,11-10-,14-13-,17-16-/t40-,41+/m0/s1 |
| SMILES | CCCCC/C=C\C/C=C\C/C=C\C/C=C\CCCCCCCCCCCCCCCCCC(=O)O[C@H](COC(C)=O)COP(=O)([O-])OC[C@@H](O)COP(=O)([O-])[O-] |
MNX internals
| InChI (mnx) | InChI=1/C42H76O13P2/c1-3-4-5-6-7-8-9-10-11-12-13-14-15-16-17-18-19-20-21-22-23-24-25-26-27-28-29-30-31-32-33-34-42(45)55-41(37-51-39(2)43)38-54-57(49,50)53-36-40(44)35-52-56(46,47)48/h7-8,10-11,13-14,16-17,40-41,44H,3-6,9,12,15,18-38H2,1-2H3,(H,49,50)(H2,46,47,48)/b8-7-,11-10-,14-13-,17-16-/t40-,41+/m0/s1 |
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| SMILES (mnx) | [CH3:1][CH2:3][CH2:4][CH2:5][CH2:6]/[CH:7]=[CH:8]\[CH2:9]/[CH:10]=[CH:11]\[CH2:12]/[CH:13]=[CH:14]\[CH2:15]/[CH:16]=[CH:17]\[CH2:18][CH2:19][CH2:20][CH2:21][CH2:22][CH2:23][CH2:24][CH2:25][CH2:26][CH2:27][CH2:28][CH2:29][CH2:30][CH2:31][CH2:32][CH2:33][CH2:34][C:42](=[O:45])[O:55][C@H:41]([CH2:37][O:51][C:39]([CH3:2])=[O:43])[CH2:38][O:54][P:57]([OH:49])(=[O:50])[O:53][CH2:36][C@H:40]([CH2:35][O:52][P:56]([OH:46])([OH:47])=[O:48])[OH:44] |
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