| Properties | Image |
MNX_ID | MNXM362714 |
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reference | slm:000240068 |
formula | C63H122O6 |
global charge | 0 |
mol weight | 975.663 |
InChIKey | KRCVAPGVUVQXAF-AKAJXFOGSA-N |
InChI | InChI=1S/C63H122O6/c1-5-7-9-11-13-15-17-19-21-22-23-24-25-26-27-28-29-30-31-33-35-39-44-48-52-56-63(66)69-60(58-68-62(65)55-51-47-43-40-36-37-41-45-49-53-59(3)4)57-67-61(64)54-50-46-42-38-34-32-20-18-16-14-12-10-8-6-2/h59-60H,5-58H2,1-4H3/t60-/m1/s1 |
SMILES | CCCCCCCCCCCCCCCCCCCCCCCCCCCC(=O)O[C@H](COC(=O)CCCCCCCCCCCCCCCC)COC(=O)CCCCCCCCCCCC(C)C |
MNX internals
InChI (mnx) | InChI=1/C63H122O6/c1-5-7-9-11-13-15-17-19-21-22-23-24-25-26-27-28-29-30-31-33-35-39-44-48-52-56-63(66)69-60(58-68-62(65)55-51-47-43-40-36-37-41-45-49-53-59(3)4)57-67-61(64)54-50-46-42-38-34-32-20-18-16-14-12-10-8-6-2/h59-60H,5-58H2,1-4H3/t60-/m1/s1 |
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SMILES (mnx) | [CH3:1][CH2:5][CH2:7][CH2:9][CH2:11][CH2:13][CH2:15][CH2:17][CH2:19][CH2:21][CH2:22][CH2:23][CH2:24][CH2:25][CH2:26][CH2:27][CH2:28][CH2:29][CH2:30][CH2:31][CH2:33][CH2:35][CH2:39][CH2:44][CH2:48][CH2:52][CH2:56][C:63](=[O:66])[O:69][C@H:60]([CH2:57][O:67][C:61]([CH2:54][CH2:50][CH2:46][CH2:42][CH2:38][CH2:34][CH2:32][CH2:20][CH2:18][CH2:16][CH2:14][CH2:12][CH2:10][CH2:8][CH2:6][CH3:2])=[O:64])[CH2:58][O:68][C:62]([CH2:55][CH2:51][CH2:47][CH2:43][CH2:40][CH2:36][CH2:37][CH2:41][CH2:45][CH2:49][CH2:53][CH:59]([CH3:3])[CH3:4])=[O:65] |
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