| Properties | Image |
|---|
| MNX_ID | MNXM1138718 |
 |
| reference | envipathM:...1517b09dcc32 |
| formula | C37H62O11 |
| global charge | 0 |
| mol weight | 682.892 |
| InChIKey | BMZBQJNXJHTXBL-UHFFFAOYSA-N |
| InChI | InChI=1S/C37H62O11/c1-3-5-18-31-33(47-31)23-34-32(48-34)20-12-9-10-17-28(40)36(42)37(43)45-25-27(39)24-44-35(41)22-13-8-6-7-11-19-29-30(46-29)21-14-16-26(38)15-4-2/h14,16,26,28-34,36,38,40,42H,3-13,15,17-25H2,1-2H3 |
| SMILES | CCCCC1OC1CC1OC1CCCCCC(O)C(O)C(=O)OCC(=O)COC(=O)CCCCCCCC1OC1CC=CC(O)CCC |
MNX internals
| InChI (mnx) | InChI=1/C37H62O11/c1-3-5-18-31-33(47-31)23-34-32(48-34)20-12-9-10-17-28(40)36(42)37(43)45-25-27(39)24-44-35(41)22-13-8-6-7-11-19-29-30(46-29)21-14-16-26(38)15-4-2/h14,16,26,28-34,36,38,40,42H,3-13,15,17-25H2,1-2H3/b16-14?/t26?,28?,29?,30?,31?,32?,33?,34?,36? |
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| SMILES (mnx) | [CH3:1][CH2:3][CH2:5][CH2:18][CH:31]1[CH:33]([CH2:23][CH:34]2[CH:32]([CH2:20][CH2:12][CH2:9][CH2:10][CH2:17][CH:28]([CH:36]([C:37](=[O:43])[O:45][CH2:25][C:27]([CH2:24][O:44][C:35]([CH2:22][CH2:13][CH2:8][CH2:6][CH2:7][CH2:11][CH2:19][CH:29]3[CH:30]([CH2:21][CH:14]=[CH:16][CH:26]([CH2:15][CH2:4][CH3:2])[OH:38])[O:46]3)=[O:41])=[O:39])[OH:42])[OH:40])[O:48]2)[O:47]1 |
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