| Properties | Image |
|---|
| MNX_ID | MNXM1175482 |
 |
| reference | envipathM:...daece07cadb2 |
| formula | C54H90O12 |
| global charge | 0 |
| mol weight | 931.302 |
| InChIKey | SDTOEMYNHRABED-UHFFFAOYSA-N |
| InChI | InChI=1S/C54H90O12/c1-3-5-7-25-32-44(56)53-48(66-53)36-28-19-18-21-29-37-51(58)61-41-43(63-52(59)38-30-20-16-14-12-10-8-9-11-13-15-17-24-31-39-55)42-62-54(60)45(57)33-26-22-23-27-35-47-50(65-47)40-49-46(64-49)34-6-4-2/h8-9,13,15,25,32,43-44,46-50,53,55-56H,3-7,10-12,14,16-24,26-31,33-42H2,1-2H3 |
| SMILES | CCCCC=CC(O)C1OC1CCCCCCCC(=O)OCC(COC(=O)C(=O)CCCCCCC1OC1CC1OC1CCCC)OC(=O)CCCCCCCC=CCC=CCCCCO |
MNX internals
| InChI (mnx) | InChI=1/C54H90O12/c1-3-5-7-25-32-44(56)53-48(66-53)36-28-19-18-21-29-37-51(58)61-41-43(63-52(59)38-30-20-16-14-12-10-8-9-11-13-15-17-24-31-39-55)42-62-54(60)45(57)33-26-22-23-27-35-47-50(65-47)40-49-46(64-49)34-6-4-2/h8-9,13,15,25,32,43-44,46-50,53,55-56H,3-7,10-12,14,16-24,26-31,33-42H2,1-2H3/b9-8?,15-13?,32-25?/t43?,44?,46?,47?,48?,49?,50?,53? |
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| SMILES (mnx) | [CH3:1][CH2:3][CH2:5][CH2:7][CH:25]=[CH:32][CH:44]([CH:53]1[CH:48]([CH2:36][CH2:28][CH2:19][CH2:18][CH2:21][CH2:29][CH2:37][C:51](=[O:58])[O:61][CH2:41][CH:43]([CH2:42][O:62][C:54]([C:45]([CH2:33][CH2:26][CH2:22][CH2:23][CH2:27][CH2:35][CH:47]2[CH:50]([CH2:40][CH:49]3[CH:46]([CH2:34][CH2:6][CH2:4][CH3:2])[O:64]3)[O:65]2)=[O:57])=[O:60])[O:63][C:52]([CH2:38][CH2:30][CH2:20][CH2:16][CH2:14][CH2:12][CH2:10][CH:8]=[CH:9][CH2:11][CH:13]=[CH:15][CH2:17][CH2:24][CH2:31][CH2:39][OH:55])=[O:59])[O:66]1)[OH:56] |
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