| Properties | Image | Occurences in reactions |
|---|
| MNX_ID | MNXM1377032 | 
|
| #reac |
|---|
| in my sandbox |
0 |
| in MNXref (generic) | 1 |
| in models (compartimentalized) |
0 |
|
| formula | C36H56O9 |
| charge | 0 |
| mass | 632.835 |
| reference | metacycM:CPD-9472 |
| InChIKey | JGTHNRAJDIUMIQ-UHFFFAOYSA-N |
| InChI | InChI=1S/C36H56O9/c1-31(2)13-15-36(30(43)45-29-28(42)27(41)26(40)22(18-37)44-29)16-14-34(5)20(21(36)17-31)7-8-24-32(3)11-10-25(39)33(4,19-38)23(32)9-12-35(24,34)6/h7,19,21-29,37,39-42H,8-18H2,1-6H3 |
| SMILES | [CH3:1][C:31]1([CH3:2])[CH2:13][CH2:15][C:36]2([C:30](=[O:43])[O:45][CH:29]3[CH:28]([OH:42])[CH:27]([OH:41])[CH:26]([OH:40])[CH:22]([CH2:18][OH:37])[O:44]3)[CH2:16][CH2:14][C:34]3([CH3:5])[C:20](=[CH:7][CH2:8][CH:24]4[C:32]5([CH3:3])[CH2:11][CH2:10][CH:25]([OH:39])[C:33]([CH3:4])([CH:19]=[O:38])[CH:23]5[CH2:9][CH2:12][C:35]43[CH3:6])[CH:21]2[CH2:17]1 |
|
