| Properties | Image |
|---|
| MNX_ID | MNXM1190037 |
 |
| reference | envipathM:...8a8ea3d918e8 |
| formula | C37H62O10 |
| global charge | 0 |
| mol weight | 666.893 |
| InChIKey | NBHFAGIWNIGXPN-UHFFFAOYSA-N |
| InChI | InChI=1S/C37H62O10/c1-3-5-20-32-33(46-32)25-34-37(47-34)31(41)19-14-11-12-15-21-35(42)44-27-30(26-38)45-36(43)22-16-10-8-6-7-9-13-18-29(40)24-23-28(39)17-4-2/h13,18,23-24,26,28-34,37,39-41H,3-12,14-17,19-22,25,27H2,1-2H3 |
| SMILES | CCCCC1OC1CC1OC1C(O)CCCCCCC(=O)OCC(C=O)OC(=O)CCCCCCCC=CC(O)C=CC(O)CCC |
MNX internals
| InChI (mnx) | InChI=1/C37H62O10/c1-3-5-20-32-33(46-32)25-34-37(47-34)31(41)19-14-11-12-15-21-35(42)44-27-30(26-38)45-36(43)22-16-10-8-6-7-9-13-18-29(40)24-23-28(39)17-4-2/h13,18,23-24,26,28-34,37,39-41H,3-12,14-17,19-22,25,27H2,1-2H3/b18-13?,24-23?/t28?,29?,30?,31?,32?,33?,34?,37? |
 |
| SMILES (mnx) | [CH3:1][CH2:3][CH2:5][CH2:20][CH:32]1[CH:33]([CH2:25][CH:34]2[CH:37]([CH:31]([CH2:19][CH2:14][CH2:11][CH2:12][CH2:15][CH2:21][C:35](=[O:42])[O:44][CH2:27][CH:30]([CH:26]=[O:38])[O:45][C:36]([CH2:22][CH2:16][CH2:10][CH2:8][CH2:6][CH2:7][CH2:9][CH:13]=[CH:18][CH:29]([CH:24]=[CH:23][CH:28]([CH2:17][CH2:4][CH3:2])[OH:39])[OH:40])=[O:43])[OH:41])[O:47]2)[O:46]1 |
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