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Name | Deltorphin II |
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Molecular formula | C38H54N8O10 |
IUPAC name | (4S)-4-[[(2S)-2-[[(2R)-2-[[(2S)-2-amino-3-(4-hydroxyphenyl)propanoyl]amino]propanoyl]amino]-3-phenylpropanoyl]amino]-5-[[(2S)-1-[[(2S)-1-[(2-amino-2-oxoethyl)amino]-3-methyl-1-oxobutan-2-yl]amino]-3-methyl-1-oxobutan-2-yl]amino]-5-oxopentanoic acid |
Molecular weight | 782.896 |
Hydrogen bond acceptor | 11 |
Hydrogen bond donor | 10 |
XlogP | -1.3 |
Synonyms | (S)-5-((S)-1-((S)-1-(2-amino-2-oxoethylamino)-3-methyl-1-oxobutan-2-ylamino)-3-methyl-1-oxobutan-2-ylamino)-4-((S)-2-((R)-2-((S)-2-amino-3-(4-hydroxyphenyl)propanamido)propanamido)-3-phenylpropanamido)-5-oxopentanoic acid C18095 Deltorphin-II Tyr-D-Ala-Phe-Glu-Val-Val-Gly amide 4-(2-{2-[2-Amino-3-(4-hydroxy-phenyl)-propionylamino]-propionylamino}-3-phenyl-propionylamino)-4-{1-[1-(carbamoylmethyl-carbamoyl)-2-methyl-propylcarbamoyl]-2-methyl-propylcarbamoyl}-butyric acid (deltorphin B) [ Show all ] |
Inchi Key | NUNBRHVOPFWRRG-RCEFDBTISA-N |
Inchi ID | InChI=1S/C38H54N8O10/c1-20(2)31(37(55)41-19-29(40)48)46-38(56)32(21(3)4)45-35(53)27(15-16-30(49)50)43-36(54)28(18-23-9-7-6-8-10-23)44-33(51)22(5)42-34(52)26(39)17-24-11-13-25(47)14-12-24/h6-14,20-22,26-28,31-32,47H,15-19,39H2,1-5H3,(H2,40,48)(H,41,55)(H,42,52)(H,43,54)(H,44,51)(H,45,53)(H,46,56)(H,49,50)/t22-,26+,27+,28+,31+,32+/m1/s1 |
PubChem CID | 10033203 |
ChEMBL | CHEMBL20226 |
IUPHAR | N/A |
BindingDB | 50000507 |
DrugBank | N/A |
Structure | ![]() |
Lipinski's druglikeness | This ligand has more than 5 hydrogen bond donor. This ligand has more than 10 hydrogen bond acceptor. This ligand is heavier than 500 daltons. |
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GLASS ID | Name | UniProt | Gene | Species | Length |
---|---|---|---|---|---|
232492 | Delta-type opioid receptor | P41143 | OPRD1 | Homo sapiens (Human) | 372 |
232493 | Delta-type opioid receptor | P33533 | Oprd1 | Rattus norvegicus (Rat) | 372 |
461233 | Delta-type opioid receptor | P79291 | OPRD1 | Sus scrofa (Pig) | 228 |
491782 | Delta-type opioid receptor | P32300 | Oprd1 | Mus musculus (Mouse) | 372 |
232494 | Kappa-type opioid receptor | P41144 | OPRK1 | Cavia porcellus (Guinea pig) | 380 |
232495 | Kappa-type opioid receptor | P41145 | OPRK1 | Homo sapiens (Human) | 380 |
491780 | Mu-type opioid receptor | P97266 | OPRM1 | Cavia porcellus (Guinea pig) | 98 |
491781 | Mu-type opioid receptor | P33535 | Oprm1 | Rattus norvegicus (Rat) | 398 |
556390 | Mu-type opioid receptor | P35372 | OPRM1 | Homo sapiens (Human) | 400 |
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