| Properties | Image | with InChI numbering | Occurences in reactions |
|---|
| MNX_ID | MNXM1371420 |
 |
 |
| #reac |
|---|
| in my sandbox |
0 |
| in MNXref (generic) | 2 |
| in models (compartimentalized) |
0 |
|
| formula | C27H42O8 |
| charge | 0 |
| mass | 494.625 |
| reference | metacycM:CPD-15603 |
| InChIKey | ZSMBGSCPNXMBIR-UHFFFAOYSA-N |
| InChI | InChI=1S/C27H42O8/c1-23(33,14-28)8-7-22(32)26(4,34)21-6-10-27(35)16-11-18(29)17-12-19(30)20(31)13-24(17,2)15(16)5-9-25(21,27)3/h11,14-15,17,19-22,30-35H,5-10,12-13H2,1-4H3 |
| SMILES | [CH3:1][C:23]([CH2:8][CH2:7][CH:22]([C:26]([CH3:4])([CH:21]1[CH2:6][CH2:10][C:27]2([OH:35])[C:16]3=[CH:11][C:18](=[O:29])[CH:17]4[CH2:12][CH:19]([OH:30])[CH:20]([OH:31])[CH2:13][C:24]4([CH3:2])[CH:15]3[CH2:5][CH2:9][C:25]12[CH3:3])[OH:34])[OH:32])([CH:14]=[O:28])[OH:33] |
|
