| Properties | Image | Occurences in reactions |
MNX_ID | MNXM530638 |
|
| #reac |
in my sandbox |
0 |
in MNXref (generic) | 0 |
in models (compartimentalized) |
0 |
|
formula | C29H39N3O6S |
charge | 0 |
mass | 557.25596 |
reference | chebi:96181 |
InChIKey | BANHLTBDTXCVOB-KHVXQDHOSA-N |
InChI | InChI=1S/C29H39N3O6S/c1-22-18-32(23(2)21-33)39(35,36)28-12-11-25(10-9-24-7-5-4-6-8-24)17-26(28)38-27(22)19-30(3)29(34)20-31-13-15-37-16-14-31/h4-12,17,22-23,27,33H,13-16,18-21H2,1-3H3/t22-,23+,27+/m1/s1 |
SMILES | C[C@@H](CO)N1C[C@@H](C)[C@H](CN(C)C(=O)CN2CCOCC2)Oc2cc(C=Cc3ccccc3)ccc2S1(=O)=O |
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