| Properties | Image |
MNX_ID | MNXM938623 |
 |
reference | slm:000631008 |
formula | C64H115NO9P |
global charge | -1 |
mol weight | 1073.596 |
InChIKey | AFUUTKWMBDFDJB-RLDPJLGTSA-M |
InChI | InChI=1S/C64H116NO9P/c1-4-7-10-13-16-18-20-22-23-24-25-26-27-28-29-30-31-32-33-34-35-36-37-38-39-40-42-43-46-49-52-55-63(67)71-59-61(74-64(68)56-53-50-47-44-41-21-19-17-14-11-8-5-2)60-73-75(69,70)72-58-57-65-62(66)54-51-48-45-15-12-9-6-3/h7,10,16,18,22-23,25-26,28-29,61H,4-6,8-9,11-15,17,19-21,24,27,30-60H2,1-3H3,(H,65,66)(H,69,70)/p-1/b10-7-,18-16-,23-22-,26-25-,29-28-/t61-/m1/s1 |
SMILES | CC/C=C\C/C=C\C/C=C\C/C=C\C/C=C\CCCCCCCCCCCCCCCCCC(=O)OC[C@H](COP(=O)([O-])OCCNC(=O)CCCCCCCCC)OC(=O)CCCCCCCCCCCCCC |
MNX internals
InChI (mnx) | InChI=1/C64H116NO9P/c1-4-7-10-13-16-18-20-22-23-24-25-26-27-28-29-30-31-32-33-34-35-36-37-38-39-40-42-43-46-49-52-55-63(67)71-59-61(74-64(68)56-53-50-47-44-41-21-19-17-14-11-8-5-2)60-73-75(69,70)72-58-57-65-62(66)54-51-48-45-15-12-9-6-3/h7,10,16,18,22-23,25-26,28-29,61H,4-6,8-9,11-15,17,19-21,24,27,30-60H2,1-3H3,(H,65,66)(H,69,70)/b10-7-,18-16-,23-22-,26-25-,29-28-/t61-/m1/s1 |
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SMILES (mnx) | [CH3:1][CH2:4]/[CH:7]=[CH:10]\[CH2:13]/[CH:16]=[CH:18]\[CH2:20]/[CH:22]=[CH:23]\[CH2:24]/[CH:25]=[CH:26]\[CH2:27]/[CH:28]=[CH:29]\[CH2:30][CH2:31][CH2:32][CH2:33][CH2:34][CH2:35][CH2:36][CH2:37][CH2:38][CH2:39][CH2:40][CH2:42][CH2:43][CH2:46][CH2:49][CH2:52][CH2:55][C:63](=[O:67])[O:71][CH2:59][C@H:61]([CH2:60][O:73][P:75]([OH:69])(=[O:70])[O:72][CH2:58][CH2:57][N:65]=[C:62]([CH2:54][CH2:51][CH2:48][CH2:45][CH2:15][CH2:12][CH2:9][CH2:6][CH3:3])[OH:66])[O:74][C:64]([CH2:56][CH2:53][CH2:50][CH2:47][CH2:44][CH2:41][CH2:21][CH2:19][CH2:17][CH2:14][CH2:11][CH2:8][CH2:5][CH3:2])=[O:68] |
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