| Properties | Image | Occurences in reactions |
MNX_ID | MNXM1370918 |
|
| #reac |
in my sandbox |
0 |
in MNXref (generic) | 3 |
in models (compartimentalized) |
1 |
|
formula | C28H50O4 |
charge | 0 |
mass | 450.704 |
reference | chebi:188499 |
InChIKey | QQPPQQNYVDYNAA-QJZSHHPBSA-N |
InChI | InChI=1S/C28H50O4/c1-15(2)16(3)25(31)26(32)17(4)20-7-8-21-19-14-24(30)23-13-18(29)9-11-28(23,6)22(19)10-12-27(20,21)5/h15-26,29-32H,7-14H2,1-6H3/t16-,17-,18-,19-,20+,21-,22-,23+,24-,25+,26+,27+,28+/m0/s1 |
SMILES | [CH3:1][CH:15]([CH3:2])[C@H:16]([CH3:3])[C@H:25]([C@@H:26]([C@@H:17]([CH3:4])[C@H:20]1[CH2:7][CH2:8][C@H:21]2[C@@H:19]3[CH2:14][C@H:24]([OH:30])[C@H:23]4[CH2:13][C@@H:18]([OH:29])[CH2:9][CH2:11][C@:28]4([CH3:6])[C@H:22]3[CH2:10][CH2:12][C@:27]12[CH3:5])[OH:32])[OH:31] |
|