| Properties | Image | Occurences in reactions |
MNX_ID | MNXM106172 |
|
| #reac |
in my sandbox |
0 |
in MNXref (generic) | 0 |
in models (compartimentalized) |
0 |
|
formula | C32H39NO6S |
charge | 0 |
mass | 565.24981 |
reference | keggD:D04718 |
InChIKey | GBKONKCASNNUQD-ATVRCVQASA-N |
InChI | InChI=1S/C22H29NO2.C10H8O3S.H2O/c1-5-21(24)25-22(18(2)17-23(3)4,20-14-10-7-11-15-20)16-19-12-8-6-9-13-19;11-14(12,13)10-6-5-8-3-1-2-4-9(8)7-10;/h6-15,18H,5,16-17H2,1-4H3;1-7H,(H,11,12,13);1H2/t18-,22+;;/m0../s1 |
SMILES | CCC(=O)O[C@@](Cc1ccccc1)(c1ccccc1)[C@@H](C)CN(C)C.O.O=S(=O)(O)c1ccc2ccccc2c1 |
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