| Properties | Image |
|---|
| MNX_ID | MNXM1190720 |
 |
| reference | envipathM:...c2e1107bfdeb |
| formula | C37H62O9 |
| global charge | 0 |
| mol weight | 650.894 |
| InChIKey | PBGPYMUYTGQPCN-UHFFFAOYSA-N |
| InChI | InChI=1S/C37H62O9/c1-3-5-7-8-9-10-11-12-13-14-15-16-17-22-26-36(42)45-30(28-38)29-44-35(41)25-21-19-18-20-23-31(39)37(43)32(40)27-34-33(46-34)24-6-4-2/h8-9,11-12,28,30-31,33-34,37,39,43H,3-7,10,13-27,29H2,1-2H3 |
| SMILES | CCCCC=CCC=CCCCCCCCC(=O)OC(C=O)COC(=O)CCCCCCC(O)C(O)C(=O)CC1OC1CCCC |
MNX internals
| InChI (mnx) | InChI=1/C37H62O9/c1-3-5-7-8-9-10-11-12-13-14-15-16-17-22-26-36(42)45-30(28-38)29-44-35(41)25-21-19-18-20-23-31(39)37(43)32(40)27-34-33(46-34)24-6-4-2/h8-9,11-12,28,30-31,33-34,37,39,43H,3-7,10,13-27,29H2,1-2H3/b9-8?,12-11?/t30?,31?,33?,34?,37? |
 |
| SMILES (mnx) | [CH3:1][CH2:3][CH2:5][CH2:7][CH:8]=[CH:9][CH2:10][CH:11]=[CH:12][CH2:13][CH2:14][CH2:15][CH2:16][CH2:17][CH2:22][CH2:26][C:36](=[O:42])[O:45][CH:30]([CH:28]=[O:38])[CH2:29][O:44][C:35]([CH2:25][CH2:21][CH2:19][CH2:18][CH2:20][CH2:23][CH:31]([CH:37]([C:32]([CH2:27][CH:34]1[CH:33]([CH2:24][CH2:6][CH2:4][CH3:2])[O:46]1)=[O:40])[OH:43])[OH:39])=[O:41] |
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