| Properties | Image |
|---|
| MNX_ID | MNXM1192050 |
 |
| reference | envipathM:...ae7dc5ff820f |
| formula | C37H64O11 |
| global charge | 0 |
| mol weight | 684.908 |
| InChIKey | QLUSWZYZWGWFNB-UHFFFAOYSA-N |
| InChI | InChI=1S/C37H64O11/c1-2-3-21-32-34(47-32)25-35-33(48-35)22-15-9-8-13-20-31(42)37(44)45-27-28(26-39)46-36(43)23-16-11-14-19-30(41)29(40)18-12-7-5-4-6-10-17-24-38/h4-5,12,18,28-35,38-42H,2-3,6-11,13-17,19-27H2,1H3 |
| SMILES | CCCCC1OC1CC1OC1CCCCCCC(O)C(=O)OCC(CO)OC(=O)CCCCCC(O)C(O)C=CCC=CCCCCO |
MNX internals
| InChI (mnx) | InChI=1/C37H64O11/c1-2-3-21-32-34(47-32)25-35-33(48-35)22-15-9-8-13-20-31(42)37(44)45-27-28(26-39)46-36(43)23-16-11-14-19-30(41)29(40)18-12-7-5-4-6-10-17-24-38/h4-5,12,18,28-35,38-42H,2-3,6-11,13-17,19-27H2,1H3/b5-4?,18-12?/t28?,29?,30?,31?,32?,33?,34?,35? |
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| SMILES (mnx) | [CH3:1][CH2:2][CH2:3][CH2:21][CH:32]1[CH:34]([CH2:25][CH:35]2[CH:33]([CH2:22][CH2:15][CH2:9][CH2:8][CH2:13][CH2:20][CH:31]([C:37](=[O:44])[O:45][CH2:27][CH:28]([CH2:26][OH:39])[O:46][C:36]([CH2:23][CH2:16][CH2:11][CH2:14][CH2:19][CH:30]([CH:29]([CH:18]=[CH:12][CH2:7][CH:5]=[CH:4][CH2:6][CH2:10][CH2:17][CH2:24][OH:38])[OH:40])[OH:41])=[O:43])[OH:42])[O:48]2)[O:47]1 |
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