| Properties | Image |
|---|
| MNX_ID | MNXM1173470 |
 |
| reference | envipathM:...d62b51b95302 |
| formula | C37H62O9 |
| global charge | 0 |
| mol weight | 650.894 |
| InChIKey | MMBWAJXKBGNPCD-UHFFFAOYSA-N |
| InChI | InChI=1S/C37H62O9/c1-3-5-7-9-10-12-16-22-30(39)23-17-13-14-21-27-35(41)45-31(28-38)29-44-37(43)36(42)32(40)24-18-15-20-26-34-33(46-34)25-19-11-8-6-4-2/h9-11,16,19,22,30-31,33-34,36,38-39,42H,3-8,12-15,17-18,20-21,23-29H2,1-2H3 |
| SMILES | CCCCC=CCC=CC(O)CCCCCCC(=O)OC(CO)COC(=O)C(O)C(=O)CCCCCC1OC1CC=CCCCC |
MNX internals
| InChI (mnx) | InChI=1/C37H62O9/c1-3-5-7-9-10-12-16-22-30(39)23-17-13-14-21-27-35(41)45-31(28-38)29-44-37(43)36(42)32(40)24-18-15-20-26-34-33(46-34)25-19-11-8-6-4-2/h9-11,16,19,22,30-31,33-34,36,38-39,42H,3-8,12-15,17-18,20-21,23-29H2,1-2H3/b10-9?,19-11?,22-16?/t30?,31?,33?,34?,36? |
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| SMILES (mnx) | [CH3:1][CH2:3][CH2:5][CH2:7][CH:9]=[CH:10][CH2:12][CH:16]=[CH:22][CH:30]([CH2:23][CH2:17][CH2:13][CH2:14][CH2:21][CH2:27][C:35](=[O:41])[O:45][CH:31]([CH2:28][OH:38])[CH2:29][O:44][C:37]([CH:36]([C:32]([CH2:24][CH2:18][CH2:15][CH2:20][CH2:26][CH:34]1[CH:33]([CH2:25][CH:19]=[CH:11][CH2:8][CH2:6][CH2:4][CH3:2])[O:46]1)=[O:40])[OH:42])=[O:43])[OH:39] |
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