| Properties | Image |
|---|
| MNX_ID | MNXM1110634 |
 |
| reference | hmdb:HMDB0081666 |
| formula | C66H128O17P2 |
| global charge | 0 |
| mol weight | 1255.681 |
| InChIKey | RVEPEHAGESSARW-ZOUCRUKKSA-N |
| InChI | InChI=1S/C66H128O17P2/c1-56(2)42-34-26-18-16-14-12-10-9-11-13-15-17-19-32-40-48-65(70)82-61(52-76-63(68)46-38-30-23-20-27-35-43-57(3)4)54-80-84(72,73)78-50-60(67)51-79-85(74,75)81-55-62(83-66(71)49-41-33-25-22-29-37-45-59(7)8)53-77-64(69)47-39-31-24-21-28-36-44-58(5)6/h56-62,67H,9-55H2,1-8H3,(H,72,73)(H,74,75)/t60-,61+,62+/m0/s1 |
| SMILES | CC(C)CCCCCCCCCCCCCCCCCC(=O)O[C@H](COC(=O)CCCCCCCCC(C)C)COP(=O)(O)OC[C@H](O)COP(=O)(O)OC[C@@H](COC(=O)CCCCCCCCC(C)C)OC(=O)CCCCCCCCC(C)C |
MNX internals
| InChI (mnx) | InChI=1/C66H128O17P2/c1-56(2)42-34-26-18-16-14-12-10-9-11-13-15-17-19-32-40-48-65(70)82-61(52-76-63(68)46-38-30-23-20-27-35-43-57(3)4)54-80-84(72,73)78-50-60(67)51-79-85(74,75)81-55-62(83-66(71)49-41-33-25-22-29-37-45-59(7)8)53-77-64(69)47-39-31-24-21-28-36-44-58(5)6/h56-62,67H,9-55H2,1-8H3,(H,72,73)(H,74,75)/t60-,61+,62+/m0/s1 |
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| SMILES (mnx) | [CH3:1][CH:56]([CH3:2])[CH2:42][CH2:34][CH2:26][CH2:18][CH2:16][CH2:14][CH2:12][CH2:10][CH2:9][CH2:11][CH2:13][CH2:15][CH2:17][CH2:19][CH2:32][CH2:40][CH2:48][C:65](=[O:70])[O:82][C@H:61]([CH2:52][O:76][C:63]([CH2:46][CH2:38][CH2:30][CH2:23][CH2:20][CH2:27][CH2:35][CH2:43][CH:57]([CH3:3])[CH3:4])=[O:68])[CH2:54][O:80][P:84]([OH:72])(=[O:73])[O:78][CH2:50][C@@H:60]([CH2:51][O:79][P:85]([OH:74])(=[O:75])[O:81][CH2:55][C@@H:62]([CH2:53][O:77][C:64]([CH2:47][CH2:39][CH2:31][CH2:24][CH2:21][CH2:28][CH2:36][CH2:44][CH:58]([CH3:5])[CH3:6])=[O:69])[O:83][C:66]([CH2:49][CH2:41][CH2:33][CH2:25][CH2:22][CH2:29][CH2:37][CH2:45][CH:59]([CH3:7])[CH3:8])=[O:71])[OH:67] |
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