| Properties | Image | Occurences in reactions |
|---|
| MNX_ID | MNXM1371004 | 
|
| #reac |
|---|
| in my sandbox |
0 |
| in MNXref (generic) | 2 |
| in models (compartimentalized) |
0 |
|
| formula | C41H66O15 |
| charge | 0 |
| mass | 798.964 |
| reference | metacycM:CPD-16625 |
| InChIKey | ZDHABOVHCKZVCM-UHFFFAOYSA-N |
| InChI | InChI=1S/C41H66O15/c1-35(17-43)12-23-37(3,13-24(35)46)25(47)14-40(6)39(5)10-7-21-36(2,22(39)11-27-41(23,40)56-27)9-8-26(38(21,4)18-44)54-34-32(28(48)19(45)16-52-34)55-33-31(51)30(50)29(49)20(15-42)53-33/h17,19-34,42,44-51H,7-16,18H2,1-6H3 |
| SMILES | [CH3:1][C:35]1([CH:17]=[O:43])[CH2:12][CH:23]2[C:37]([CH3:3])([CH2:13][CH:24]1[OH:46])[CH:25]([OH:47])[CH2:14][C:40]1([CH3:6])[C:39]3([CH3:5])[CH2:10][CH2:7][CH:21]4[C:36]([CH3:2])([CH2:9][CH2:8][CH:26]([O:54][CH:34]5[CH:32]([O:55][CH:33]6[CH:31]([OH:51])[CH:30]([OH:50])[CH:29]([OH:49])[CH:20]([CH2:15][OH:42])[O:53]6)[CH:28]([OH:48])[CH:19]([OH:45])[CH2:16][O:52]5)[C:38]4([CH3:4])[CH2:18][OH:44])[CH:22]3[CH2:11][CH:27]3[C:41]21[O:56]3 |
|
