| Properties | Image | Occurences in reactions |
MNX_ID | MNXM1528695 |
|
| #reac |
in my sandbox |
0 |
in MNXref (generic) | 0 |
in models (compartimentalized) |
0 |
|
formula | C30H40O8 |
charge | 0 |
mass | 528.642 |
reference | lipidmapsM:LMST01160040 |
InChIKey | LKNMQSNKHQTCFH-XPFZSAMVSA-N |
InChI | InChI=1S/C30H40O8/c1-15-12-21(37-25(33)16(15)2)17(3)28(34)14-24(36-18(4)31)30(35)20-13-23-29(38-23)10-7-8-22(32)27(29,6)19(20)9-11-26(28,30)5/h7-8,17,19-21,23-24,34-35H,9-14H2,1-6H3/t17-,19+,20-,21-,23-,24+,26-,27+,28-,29-,30-/m1/s1 |
SMILES | [CH3:1][C:15]1=[C:16]([CH3:2])[C:25](=[O:33])[O:37][C@@H:21]([C@@H:17]([CH3:3])[C@:28]2([OH:34])[CH2:14][C@H:24]([O:36][C:18]([CH3:4])=[O:31])[C@:30]3([OH:35])[C@@H:20]4[CH2:13][C@@H:23]5[C@@:29]6([CH2:10][CH:7]=[CH:8][C:22](=[O:32])[C@:27]6([CH3:6])[C@H:19]4[CH2:9][CH2:11][C@:26]23[CH3:5])[O:38]5)[CH2:12]1 |
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