| Properties | Image |
|---|
| MNX_ID | MNXM1180186 |
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| reference | envipathM:...c8c74d61294d |
| formula | C37H62O11 |
| global charge | 0 |
| mol weight | 682.892 |
| InChIKey | ZOGIPQUNYBISBG-UHFFFAOYSA-N |
| InChI | InChI=1S/C37H62O11/c1-3-5-7-13-18-27(39)34-29(46-34)21-16-12-11-14-19-28(40)37(43)45-25-26(38)24-44-32(41)23-17-10-8-9-15-22-31-36(48-31)33(42)35-30(47-35)20-6-4-2/h13,18,27-31,33-36,39-40,42H,3-12,14-17,19-25H2,1-2H3 |
| SMILES | CCCCC=CC(O)C1OC1CCCCCCC(O)C(=O)OCC(=O)COC(=O)CCCCCCCC1OC1C(O)C1OC1CCCC |
MNX internals
| InChI (mnx) | InChI=1/C37H62O11/c1-3-5-7-13-18-27(39)34-29(46-34)21-16-12-11-14-19-28(40)37(43)45-25-26(38)24-44-32(41)23-17-10-8-9-15-22-31-36(48-31)33(42)35-30(47-35)20-6-4-2/h13,18,27-31,33-36,39-40,42H,3-12,14-17,19-25H2,1-2H3/b18-13?/t27?,28?,29?,30?,31?,33?,34?,35?,36? |
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| SMILES (mnx) | [CH3:1][CH2:3][CH2:5][CH2:7][CH:13]=[CH:18][CH:27]([CH:34]1[CH:29]([CH2:21][CH2:16][CH2:12][CH2:11][CH2:14][CH2:19][CH:28]([C:37](=[O:43])[O:45][CH2:25][C:26]([CH2:24][O:44][C:32]([CH2:23][CH2:17][CH2:10][CH2:8][CH2:9][CH2:15][CH2:22][CH:31]2[CH:36]([CH:33]([CH:35]3[CH:30]([CH2:20][CH2:6][CH2:4][CH3:2])[O:47]3)[OH:42])[O:48]2)=[O:41])=[O:38])[OH:40])[O:46]1)[OH:39] |
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