R31
(2S,4S,5S)-5-amino-N-(3-amino-2,2-dimethyl-3-oxopropyl)-4-hydroxy-6-{4-[2-(3-methoxypropoxy)phenyl]-3-oxopiperazin-1-yl}-2-(propan-2-yl)hexanamide
Find entries where: R31
is present as a standalone ligand in 1 entries
Chemical Component Summary | |
---|---|
Name | (2S,4S,5S)-5-amino-N-(3-amino-2,2-dimethyl-3-oxopropyl)-4-hydroxy-6-{4-[2-(3-methoxypropoxy)phenyl]-3-oxopiperazin-1-yl}-2-(propan-2-yl)hexanamide |
Identifiers | (2S,4S,5S)-5-azanyl-N-(3-azanyl-2,2-dimethyl-3-oxidanylidene-propyl)-6-[4-[2-(3-methoxypropoxy)phenyl]-3-oxidanylidene-piperazin-1-yl]-4-oxidanyl-2-propan-2-yl-hexanamide |
Formula | C28 H47 N5 O6 |
Molecular Weight | 549.703 |
Type | NON-POLYMER |
Isomeric SMILES | CC(C)[C@H](C[C@@H]([C@H](CN1CCN(C(=O)C1)c2ccccc2OCCCOC)N)O)C(=O)NCC(C)(C)C(=O)N |
InChI | InChI=1S/C28H47N5O6/c1-19(2)20(26(36)31-18-28(3,4)27(30)37)15-23(34)21(29)16-32-11-12-33(25(35)17-32)22-9-6-7-10-24(22)39-14-8-13-38-5/h6-7,9-10,19-21,23,34H,8,11-18,29H2,1-5H3,(H2,30,37)(H,31,36)/t20-,21-,23-/m0/s1 |
InChIKey | FOAHAYKWNMPVJI-FUDKSRODSA-N |
Chemical Details | |
---|---|
Formal Charge | 0 |
Atom Count | 86 |
Chiral Atom Count | 3 |
Bond Count | 87 |
Aromatic Bond Count | 6 |
Related Resource References
Resource Name | Reference |
---|---|
PubChem | 57519701 |