| Properties | Image |
MNX_ID | MNXM345754 |
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reference | slm:000475855 |
formula | C35H67O13P2 |
global charge | -3 |
mol weight | 757.856 |
InChIKey | RXPSLTIURSXCJN-JHOUSYSJSA-K |
InChI | InChI=1S/C35H70O13P2/c1-3-5-7-9-11-12-13-14-15-16-17-18-19-21-23-25-27-35(38)48-33(30-44-34(37)26-24-22-20-10-8-6-4-2)31-47-50(42,43)46-29-32(36)28-45-49(39,40)41/h32-33,36H,3-31H2,1-2H3,(H,42,43)(H2,39,40,41)/p-3/t32-,33+/m0/s1 |
SMILES | CCCCCCCCCCCCCCCCCCC(=O)O[C@H](COC(=O)CCCCCCCCC)COP(=O)([O-])OC[C@@H](O)COP(=O)([O-])[O-] |
MNX internals
InChI (mnx) | InChI=1/C35H70O13P2/c1-3-5-7-9-11-12-13-14-15-16-17-18-19-21-23-25-27-35(38)48-33(30-44-34(37)26-24-22-20-10-8-6-4-2)31-47-50(42,43)46-29-32(36)28-45-49(39,40)41/h32-33,36H,3-31H2,1-2H3,(H,42,43)(H2,39,40,41)/t32-,33+/m0/s1 |
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SMILES (mnx) | [CH3:1][CH2:3][CH2:5][CH2:7][CH2:9][CH2:11][CH2:12][CH2:13][CH2:14][CH2:15][CH2:16][CH2:17][CH2:18][CH2:19][CH2:21][CH2:23][CH2:25][CH2:27][C:35](=[O:38])[O:48][C@H:33]([CH2:30][O:44][C:34]([CH2:26][CH2:24][CH2:22][CH2:20][CH2:10][CH2:8][CH2:6][CH2:4][CH3:2])=[O:37])[CH2:31][O:47][P:50]([OH:42])(=[O:43])[O:46][CH2:29][C@H:32]([CH2:28][O:45][P:49]([OH:39])([OH:40])=[O:41])[OH:36] |
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