| Properties | Image |
MNX_ID | MNXM355999 |
 |
reference | slm:000302354 |
formula | C75H142O6 |
global charge | 0 |
mol weight | 1139.955 |
InChIKey | ITIPMEAUYXYHRH-RZIHMJRDSA-N |
InChI | InChI=1S/C75H142O6/c1-4-7-10-13-16-19-22-25-28-31-33-34-35-36-37-38-39-40-42-45-48-51-54-57-60-63-66-69-75(78)81-72(70-79-73(76)67-64-61-58-55-52-49-46-43-30-27-24-21-18-15-12-9-6-3)71-80-74(77)68-65-62-59-56-53-50-47-44-41-32-29-26-23-20-17-14-11-8-5-2/h17,20,26,29,72H,4-16,18-19,21-25,27-28,30-71H2,1-3H3/b20-17-,29-26-/t72-/m1/s1 |
SMILES | CCCCC/C=C\C/C=C\CCCCCCCCCCCC(=O)OC[C@@H](COC(=O)CCCCCCCCCCCCCCCCCCC)OC(=O)CCCCCCCCCCCCCCCCCCCCCCCCCCCCC |
MNX internals
InChI (mnx) | InChI=1/C75H142O6/c1-4-7-10-13-16-19-22-25-28-31-33-34-35-36-37-38-39-40-42-45-48-51-54-57-60-63-66-69-75(78)81-72(70-79-73(76)67-64-61-58-55-52-49-46-43-30-27-24-21-18-15-12-9-6-3)71-80-74(77)68-65-62-59-56-53-50-47-44-41-32-29-26-23-20-17-14-11-8-5-2/h17,20,26,29,72H,4-16,18-19,21-25,27-28,30-71H2,1-3H3/b20-17-,29-26-/t72-/m1/s1 |
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SMILES (mnx) | [CH3:1][CH2:4][CH2:7][CH2:10][CH2:13][CH2:16][CH2:19][CH2:22][CH2:25][CH2:28][CH2:31][CH2:33][CH2:34][CH2:35][CH2:36][CH2:37][CH2:38][CH2:39][CH2:40][CH2:42][CH2:45][CH2:48][CH2:51][CH2:54][CH2:57][CH2:60][CH2:63][CH2:66][CH2:69][C:75](=[O:78])[O:81][C@H:72]([CH2:70][O:79][C:73]([CH2:67][CH2:64][CH2:61][CH2:58][CH2:55][CH2:52][CH2:49][CH2:46][CH2:43][CH2:30][CH2:27][CH2:24][CH2:21][CH2:18][CH2:15][CH2:12][CH2:9][CH2:6][CH3:3])=[O:76])[CH2:71][O:80][C:74]([CH2:68][CH2:65][CH2:62][CH2:59][CH2:56][CH2:53][CH2:50][CH2:47][CH2:44][CH2:41][CH2:32]/[CH:29]=[CH:26]\[CH2:23]/[CH:20]=[CH:17]\[CH2:14][CH2:11][CH2:8][CH2:5][CH3:2])=[O:77] |
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