(2S)-2-[6-(1-adamantylcarbamoylamino)hexanoylamino]propanoic acid

Systemtic Name: (2S)-2-[6-(1-adamantylcarbamoylamino)hexanoylamino]propanoic acid Openeye Name: (2S)-2-[6-(1-adamantylcarbamoylamino)hexanoylamino]propanoic acid CAS Name: (2S)-2-[[6-[[(1-adamantylamino)-oxomethyl]amino]-1-oxohexyl]amino]propanoic acid IUPAC Name: (2S)-2-[6-(1-adamantylcarbamoylamino)hexanoylamino]propanoic acid Traditional Name: (2S)-2-[6-(1-adamantylcarbamoylamino)hexanoylamino]propionic acid Formula: C20H33N3O4 MolecularWeight: 379.49372

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Descriptors Computed from Structure

Canonical SMILES:

CC(C(=O)O)NC(=O)CCCCCNC(=O)NC12CC3CC(C1)CC(C3)C2

Isomeric SMILES

C[C@@H](C(=O)O)NC(=O)CCCCCNC(=O)NC12CC3CC(C1)CC(C3)C2

InChI

InChI=1S/C20H33N3O4/c1-13(18(25)26)22-17(24)5-3-2-4-6-21-19(27)23-20-10-14-7-15(11-20)9-16(8-14)12-20/h13-16H,2-12H2,1H3,(H,22,24)(H,25,26)(H2,21,23,27)/t13-,14?,15?,16?,20?/m0/s1