| Properties | Image |
|---|
| MNX_ID | MNXM1198409 |
 |
| reference | envipathM:...aeddfff2f422 |
| formula | C54H96O13 |
| global charge | 0 |
| mol weight | 953.349 |
| InChIKey | DKMNUDSYBRXFIP-UHFFFAOYSA-N |
| InChI | InChI=1S/C54H96O13/c1-3-5-7-18-26-34-46-47(66-46)35-27-20-16-23-29-37-49(58)63-41-44(65-51(60)39-31-22-15-13-11-9-8-10-12-14-19-25-32-43(56)40-55)42-64-50(59)38-30-24-17-21-28-36-48-54(67-48)53(62)52(61)45(57)33-6-4-2/h8,10,14,19,43-48,52-57,61-62H,3-7,9,11-13,15-18,20-42H2,1-2H3 |
| SMILES | CCCCCCCC1OC1CCCCCCCC(=O)OCC(COC(=O)CCCCCCCC1OC1C(O)C(O)C(O)CCCC)OC(=O)CCCCCCCC=CCC=CCCC(O)CO |
MNX internals
| InChI (mnx) | InChI=1/C54H96O13/c1-3-5-7-18-26-34-46-47(66-46)35-27-20-16-23-29-37-49(58)63-41-44(65-51(60)39-31-22-15-13-11-9-8-10-12-14-19-25-32-43(56)40-55)42-64-50(59)38-30-24-17-21-28-36-48-54(67-48)53(62)52(61)45(57)33-6-4-2/h8,10,14,19,43-48,52-57,61-62H,3-7,9,11-13,15-18,20-42H2,1-2H3/b10-8?,19-14?/t43?,44?,45?,46?,47?,48?,52?,53?,54? |
 |
| SMILES (mnx) | [CH3:1][CH2:3][CH2:5][CH2:7][CH2:18][CH2:26][CH2:34][CH:46]1[CH:47]([CH2:35][CH2:27][CH2:20][CH2:16][CH2:23][CH2:29][CH2:37][C:49](=[O:58])[O:63][CH2:41][CH:44]([CH2:42][O:64][C:50]([CH2:38][CH2:30][CH2:24][CH2:17][CH2:21][CH2:28][CH2:36][CH:48]2[CH:54]([CH:53]([CH:52]([CH:45]([CH2:33][CH2:6][CH2:4][CH3:2])[OH:57])[OH:61])[OH:62])[O:67]2)=[O:59])[O:65][C:51]([CH2:39][CH2:31][CH2:22][CH2:15][CH2:13][CH2:11][CH2:9][CH:8]=[CH:10][CH2:12][CH:14]=[CH:19][CH2:25][CH2:32][CH:43]([CH2:40][OH:55])[OH:56])=[O:60])[O:66]1 |
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