AGH
N-{(1S,2R,3S)-1-[(ALPHA-D-GALACTOPYRANOSYLOXY)METHYL]-2,3-DIHYDROXYHEPTADECYL}HEXACOSANAMIDE
Find entries where: AGH
is present as a standalone ligand in 11 entries
Chemical Component Summary | |
|---|---|
| Name | N-{(1S,2R,3S)-1-[(ALPHA-D-GALACTOPYRANOSYLOXY)METHYL]-2,3-DIHYDROXYHEPTADECYL}HEXACOSANAMIDE |
| Identifiers | N-[(2S,3S,4R)-3,4-dihydroxy-1-[(2S,3R,4S,5R,6R)-3,4,5-trihydroxy-6-(hydroxymethyl)oxan-2-yl]oxy-octadecan-2-yl]hexacosanamide |
| Formula | C50 H99 N O9 |
| Molecular Weight | 858.322 |
| Type | D-SACCHARIDE |
| Isomeric SMILES | CCCCCCCCCCCCCCCCCCCCCCCCCC(=O)N[C@@H](CO[C@@H]1[C@@H]([C@H]([C@H]([C@H](O1)CO)O)O)O)[C@@H]([C@@H](CCCCCCCCCCCCCC)O)O |
| InChI | InChI=1S/C50H99NO9/c1-3-5-7-9-11-13-15-17-18-19-20-21-22-23-24-25-26-27-29-31-33-35-37-39-45(54)51-42(41-59-50-49(58)48(57)47(56)44(40-52)60-50)46(55)43(53)38-36-34-32-30-28-16-14-12-10-8-6-4-2/h42-44,46-50,52-53,55-58H,3-41H2,1-2H3,(H,51,54)/t42-,43+,44+,46-,47-,48-,49+,50-/m0/s1 |
| InChIKey | VQFKFAKEUMHBLV-BYSUZVQFSA-N |
Chemical Details | |
|---|---|
| Formal Charge | 0 |
| Atom Count | 159 |
| Chiral Atom Count | 8 |
| Bond Count | 159 |
| Aromatic Bond Count | 0 |
Drug Info: DrugBank
| DrugBank ID | DB12232? |
|---|---|
| Name | KRN-7000 |
| Groups | investigational |
| Description | KRN7000 has been used in trials studying the treatment of Lung Cancer, Chronic Hepatitis C, Hepatitis B, Chronic, Unspecified Adult Solid Tumor, Protocol Specific, and Prevention of GvHD in Patients With Hematological Malignancies Undergoing AHSCT. |
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| Categories |
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| CAS number | 158021-47-7 |
Related Resource References
| Resource Name | Reference |
|---|---|
| PubChem | 2826713 |
| ChEMBL | CHEMBL384200 |
| ChEBI | CHEBI:466659 |
