Ligand Information
| Ligand General Information | Top | |||
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| Ligand ID |
L2D5IB
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| Ligand Name |
(3s,8ar)-N-((R)-Chroman-4-Yl)-2-((S)-2-Cyclohexyl-2-((S)-2-(Methylamino)propanamido)acetyl)octahydropyrrolo[1,2-A]pyrazine-3-Carboxamide
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| Synonyms |
CHEMBL2365533; (3s,8ar)-N-((R)-Chroman-4-Yl)-2-((S)-2-Cyclohexyl-2-((S)-2-(Methylamino)propanamido)acetyl)octahydropyrrolo[1,2-A]pyrazine-3-Carboxamide; SCHEMBL1273302; CHEMBL2316221; BDBM50425728; Q27452574; (3S,8abeta)-N-[(4R)-3,4-Dihydro-2H-1-benzopyran-4-yl]-2-[(S)-2-[[(2S)-2-(methylamino)propionyl]amino]-2-cyclohexylacetyl]octahydropyrrolo[1,2-a]pyrazine-3alpha-carboxamide; (3S,8aR)-2-{(2S)-2-Cyclohexyl-2-[(N-methyl-L-alanyl)amino]acetyl}-N-[(4R)-3,4-dihydro-2H-chromen-4-yl]octahydropyrrolo[1,2-a]pyrazine-3-carboxamide
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| Structure |
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Download2D MOL |
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| Formula |
C29H43N5O4
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| Canonical SMILES |
CC(C(=O)NC(C1CCCCC1)C(=O)N2CC3CCCN3CC2C(=O)NC4CCOC5=CC=CC=C45)NC
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| InChI |
1S/C29H43N5O4/c1-19(30-2)27(35)32-26(20-9-4-3-5-10-20)29(37)34-17-21-11-8-15-33(21)18-24(34)28(36)31-23-14-16-38-25-13-7-6-12-22(23)25/h6-7,12-13,19-21,23-24,26,30H,3-5,8-11,14-18H2,1-2H3,(H,31,36)(H,32,35)/t19-,21+,23+,24-,26-/m0/s1
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| InChIKey |
GIAUJOMDUOPYLU-XFCBJTKFSA-N
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| PubChem Compound ID | ||||
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