| Properties | Image |
|---|
| MNX_ID | MNXM1188305 |
 |
| reference | envipathM:...085ad5ed92a0 |
| formula | C37H64O11 |
| global charge | 0 |
| mol weight | 684.908 |
| InChIKey | PNVBXYQXNDBNJI-UHFFFAOYSA-N |
| InChI | InChI=1S/C37H64O11/c1-2-3-20-31-33(47-31)25-34-32(48-34)21-14-7-4-8-15-22-35(42)45-26-28(39)27-46-36(43)23-16-10-9-13-19-30(41)37(44)29(40)18-12-6-5-11-17-24-38/h6,12,24,28-34,37,39-41,44H,2-5,7-11,13-23,25-27H2,1H3 |
| SMILES | CCCCC1OC1CC1OC1CCCCCCCC(=O)OCC(O)COC(=O)CCCCCCC(O)C(O)C(O)CC=CCCCC=O |
MNX internals
| InChI (mnx) | InChI=1/C37H64O11/c1-2-3-20-31-33(47-31)25-34-32(48-34)21-14-7-4-8-15-22-35(42)45-26-28(39)27-46-36(43)23-16-10-9-13-19-30(41)37(44)29(40)18-12-6-5-11-17-24-38/h6,12,24,28-34,37,39-41,44H,2-5,7-11,13-23,25-27H2,1H3/b12-6?/t28?,29?,30?,31?,32?,33?,34?,37? |
 |
| SMILES (mnx) | [CH3:1][CH2:2][CH2:3][CH2:20][CH:31]1[CH:33]([CH2:25][CH:34]2[CH:32]([CH2:21][CH2:14][CH2:7][CH2:4][CH2:8][CH2:15][CH2:22][C:35](=[O:42])[O:45][CH2:26][CH:28]([CH2:27][O:46][C:36]([CH2:23][CH2:16][CH2:10][CH2:9][CH2:13][CH2:19][CH:30]([CH:37]([CH:29]([CH2:18][CH:12]=[CH:6][CH2:5][CH2:11][CH2:17][CH:24]=[O:38])[OH:40])[OH:44])[OH:41])=[O:43])[OH:39])[O:48]2)[O:47]1 |
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