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Name | CHEMBL3120632 |
---|---|
Molecular formula | C29H41NO2 |
IUPAC name | (1S,12S,15R,16S,17S,20S)-16-[(E)-4-methoxy-4-methylpent-2-enyl]-1,16,20-trimethyl-3-azapentacyclo[10.8.0.02,10.04,9.015,20]icosa-2(10),4,6,8-tetraen-17-ol |
Molecular weight | 435.652 |
Hydrogen bond acceptor | 2 |
Hydrogen bond donor | 2 |
XlogP | 6.5 |
Synonyms | BDBM50448076 27-O-Methylasporyzin C |
Inchi Key | TXDUYXUPRRYHRW-MYFCUFBASA-N |
Inchi ID | InChI=1S/C29H41NO2/c1-26(2,32-6)15-9-16-27(3)23-13-12-19-18-21-20-10-7-8-11-22(20)30-25(21)29(19,5)28(23,4)17-14-24(27)31/h7-11,15,19,23-24,30-31H,12-14,16-18H2,1-6H3/b15-9+/t19-,23-,24-,27-,28-,29+/m0/s1 |
PubChem CID | 76325292 |
ChEMBL | CHEMBL3120632 |
IUPHAR | N/A |
BindingDB | 50448076 |
DrugBank | N/A |
Structure | ![]() |
Lipinski's druglikeness | This ligand has a partition coefficient log P greater than 5. |
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GLASS ID | Name | UniProt | Gene | Species | Length |
---|---|---|---|---|---|
329662 | Cannabinoid receptor 1 | P21554 | CNR1 | Homo sapiens (Human) | 472 |
329665 | Cannabinoid receptor 2 | P34972 | CNR2 | Homo sapiens (Human) | 360 |
329663 | G-protein coupled receptor 55 | Q9Y2T6 | GPR55 | Homo sapiens (Human) | 319 |
329664 | N-arachidonyl glycine receptor | Q14330 | GPR18 | Homo sapiens (Human) | 331 |
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