| Properties | Image |
|---|
| MNX_ID | MNXM324980 |
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| reference | slm:000278692 |
| formula | C69H118O6 |
| global charge | 0 |
| mol weight | 1043.697 |
| InChIKey | WUGHPABFAWFZKX-NTUAYNAMSA-N |
| InChI | InChI=1S/C69H118O6/c1-4-7-10-13-16-19-22-25-27-29-31-32-33-34-35-36-38-40-42-45-48-51-54-57-60-63-69(72)75-66(64-73-67(70)61-58-55-52-49-46-43-24-21-18-15-12-9-6-3)65-74-68(71)62-59-56-53-50-47-44-41-39-37-30-28-26-23-20-17-14-11-8-5-2/h8,11-12,15,17,20-21,24,26,28,37,39,44,47,53,56,66H,4-7,9-10,13-14,16,18-19,22-23,25,27,29-36,38,40-43,45-46,48-52,54-55,57-65H2,1-3H3/b11-8-,15-12-,20-17-,24-21-,28-26-,39-37-,47-44-,56-53-/t66-/m1/s1 |
| SMILES | CC/C=C\C/C=C\C/C=C\C/C=C\C/C=C\C/C=C\CCC(=O)OC[C@@H](COC(=O)CCCCCCC/C=C\C/C=C\CCC)OC(=O)CCCCCCCCCCCCCCCCCCCCCCCCCCC |
MNX internals
| InChI (mnx) | InChI=1/C69H118O6/c1-4-7-10-13-16-19-22-25-27-29-31-32-33-34-35-36-38-40-42-45-48-51-54-57-60-63-69(72)75-66(64-73-67(70)61-58-55-52-49-46-43-24-21-18-15-12-9-6-3)65-74-68(71)62-59-56-53-50-47-44-41-39-37-30-28-26-23-20-17-14-11-8-5-2/h8,11-12,15,17,20-21,24,26,28,37,39,44,47,53,56,66H,4-7,9-10,13-14,16,18-19,22-23,25,27,29-36,38,40-43,45-46,48-52,54-55,57-65H2,1-3H3/b11-8-,15-12-,20-17-,24-21-,28-26-,39-37-,47-44-,56-53-/t66-/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][CH2:27][CH2:29][CH2:31][CH2:32][CH2:33][CH2:34][CH2:35][CH2:36][CH2:38][CH2:40][CH2:42][CH2:45][CH2:48][CH2:51][CH2:54][CH2:57][CH2:60][CH2:63][C:69](=[O:72])[O:75][C@H:66]([CH2:64][O:73][C:67]([CH2:61][CH2:58][CH2:55][CH2:52][CH2:49][CH2:46][CH2:43]/[CH:24]=[CH:21]\[CH2:18]/[CH:15]=[CH:12]\[CH2:9][CH2:6][CH3:3])=[O:70])[CH2:65][O:74][C:68]([CH2:62][CH2:59]/[CH:56]=[CH:53]\[CH2:50]/[CH:47]=[CH:44]\[CH2:41]/[CH:39]=[CH:37]\[CH2:30]/[CH:28]=[CH:26]\[CH2:23]/[CH:20]=[CH:17]\[CH2:14]/[CH:11]=[CH:8]\[CH2:5][CH3:2])=[O:71] |
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