| Properties | Image |
|---|
| MNX_ID | MNXM1182985 |
 |
| reference | envipathM:...ad20150f7a39 |
| formula | C54H92O13 |
| global charge | 0 |
| mol weight | 949.317 |
| InChIKey | GKIOOVMHUMFIPS-UHFFFAOYSA-N |
| InChI | InChI=1S/C54H92O13/c1-3-5-7-8-9-10-11-12-13-14-15-16-19-30-38-52(60)65-43(42-64-54(62)45(57)33-26-20-22-28-36-48-47(66-48)35-27-18-17-24-31-39-55)41-63-51(59)37-29-23-21-25-32-44(56)53(61)46(58)40-50-49(67-50)34-6-4-2/h8-9,11-12,18,27,43-44,46-50,53,55-56,58,61H,3-7,10,13-17,19-26,28-42H2,1-2H3 |
| SMILES | CCCCC=CCC=CCCCCCCCC(=O)OC(COC(=O)CCCCCCC(O)C(O)C(O)CC1OC1CCCC)COC(=O)C(=O)CCCCCCC1OC1CC=CCCCCO |
MNX internals
| InChI (mnx) | InChI=1/C54H92O13/c1-3-5-7-8-9-10-11-12-13-14-15-16-19-30-38-52(60)65-43(42-64-54(62)45(57)33-26-20-22-28-36-48-47(66-48)35-27-18-17-24-31-39-55)41-63-51(59)37-29-23-21-25-32-44(56)53(61)46(58)40-50-49(67-50)34-6-4-2/h8-9,11-12,18,27,43-44,46-50,53,55-56,58,61H,3-7,10,13-17,19-26,28-42H2,1-2H3/b9-8?,12-11?,27-18?/t43?,44?,46?,47?,48?,49?,50?,53? |
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| SMILES (mnx) | [CH3:1][CH2:3][CH2:5][CH2:7][CH:8]=[CH:9][CH2:10][CH:11]=[CH:12][CH2:13][CH2:14][CH2:15][CH2:16][CH2:19][CH2:30][CH2:38][C:52](=[O:60])[O:65][CH:43]([CH2:41][O:63][C:51]([CH2:37][CH2:29][CH2:23][CH2:21][CH2:25][CH2:32][CH:44]([CH:53]([CH:46]([CH2:40][CH:50]1[CH:49]([CH2:34][CH2:6][CH2:4][CH3:2])[O:67]1)[OH:58])[OH:61])[OH:56])=[O:59])[CH2:42][O:64][C:54]([C:45]([CH2:33][CH2:26][CH2:20][CH2:22][CH2:28][CH2:36][CH:48]1[CH:47]([CH2:35][CH:27]=[CH:18][CH2:17][CH2:24][CH2:31][CH2:39][OH:55])[O:66]1)=[O:57])=[O:62] |
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