| Properties | Image |
|---|
| MNX_ID | MNXM1131908 |
 |
| reference | lipidmapsM:LMST01060018 |
| formula | C32H52O6 |
| global charge | 0 |
| mol weight | 532.762 |
| InChIKey | MVBIPJLQNLNYFV-MYJWWNAKSA-N |
| InChI | InChI=1S/C32H52O6/c1-15(2)17(4)29(6)14-22(29)16(3)20-9-10-21-23-24(26(37-18(5)33)27(36)31(20,21)8)30(7)12-11-19(34)13-32(30)28(38-32)25(23)35/h15-17,19-28,34-36H,9-14H2,1-8H3/t16-,17+,19-,20+,21-,22+,23-,24+,25-,26-,27+,28+,29+,30+,31+,32+/m0/s1 |
| SMILES | CC(=O)O[C@H]1[C@H]2[C@@H]([C@H](O)[C@H]3O[C@]34C[C@@H](O)CC[C@]24C)[C@@H]2CC[C@H]([C@H](C)[C@H]3C[C@]3(C)[C@H](C)C(C)C)[C@@]2(C)[C@@H]1O |
MNX internals
| InChI (mnx) | InChI=1/C32H52O6/c1-15(2)17(4)29(6)14-22(29)16(3)20-9-10-21-23-24(26(37-18(5)33)27(36)31(20,21)8)30(7)12-11-19(34)13-32(30)28(38-32)25(23)35/h15-17,19-28,34-36H,9-14H2,1-8H3/t16-,17+,19-,20+,21-,22+,23-,24+,25-,26-,27+,28+,29+,30+,31+,32+/m0/s1 |
 |
| SMILES (mnx) | [CH3:1][CH:15]([CH3:2])[C@@H:17]([CH3:4])[C@@:29]1([CH3:6])[CH2:14][C@@H:22]1[C@@H:16]([CH3:3])[C@H:20]1[CH2:9][CH2:10][C@H:21]2[C@H:23]3[C@H:24]([C@H:26]([O:37][C:18]([CH3:5])=[O:33])[C@@H:27]([OH:36])[C@:31]12[CH3:8])[C@@:30]1([CH3:7])[CH2:12][CH2:11][C@H:19]([OH:34])[CH2:13][C@@:32]12[C@@H:28]([C@H:25]3[OH:35])[O:38]2 |
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