4-azanyl-5-[[6-azanyl-1-[[1-[[3-(1H-indol-3-yl)-1-oxidanyl-1-oxidanylidene-propan-2-yl]amino]-3-oxidanyl-1-oxidanylidene-butan-2-yl]amino]-1-oxidanylidene-hexan-2-yl]amino]-5-oxidanylidene-pentanoic acid

Systemtic Name: 4-azanyl-5-[[6-azanyl-1-[[1-[[3-(1H-indol-3-yl)-1-oxidanyl-1-oxidanylidene-propan-2-yl]amino]-3-oxidanyl-1-oxidanylidene-butan-2-yl]amino]-1-oxidanylidene-hexan-2-yl]amino]-5-oxidanylidene-pentanoic acid Openeye Name: 4-amino-5-[[5-amino-1-[[2-hydroxy-1-[[2-hydroxy-1-(1H-indol-3-ylmethyl)-2-oxo-ethyl]carbamoyl]propyl]carbamoyl]pentyl]amino]-5-oxo-pentanoic acid CAS Name: 4-amino-5-[[6-amino-1-[[3-hydroxy-1-[[1-hydroxy-3-(1H-indol-3-yl)-1-oxopropan-2-yl]amino]-1-oxobutan-2-yl]amino]-1-oxohexan-2-yl]amino]-5-oxopentanoic acid IUPAC Name: 4-amino-5-[[6-amino-1-[[3-hydroxy-1-[[1-hydroxy-3-(1H-indol-3-yl)-1-oxopropan-2-yl]amino]-1-oxobutan-2-yl]amino]-1-oxohexan-2-yl]amino]-5-oxopentanoic acid Traditional Name: 4-amino-5-[[5-amino-1-[[2-hydroxy-1-[[2-hydroxy-1-(1H-indol-3-ylmethyl)-2-keto-ethyl]carbamoyl]propyl]carbamoyl]pentyl]amino]-5-keto-valeric acid Formula: C26H38N6O8 MolecularWeight: 562.61532

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Descriptors Computed from Structure

Canonical SMILES:

CC(C(C(=O)NC(CC1=CNC2=CC=CC=C21)C(=O)O)NC(=O)C(CCCCN)NC(=O)C(CCC(=O)O)N)O

Isomeric SMILES

CC(C(C(=O)NC(CC1=CNC2=CC=CC=C21)C(=O)O)NC(=O)C(CCCCN)NC(=O)C(CCC(=O)O)N)O

InChI

InChI=1S/C26H38N6O8/c1-14(33)22(25(38)31-20(26(39)40)12-15-13-29-18-7-3-2-6-16(15)18)32-24(37)19(8-4-5-11-27)30-23(36)17(28)9-10-21(34)35/h2-3,6-7,13-14,17,19-20,22,29,33H,4-5,8-12,27-28H2,1H3,(H,30,36)(H,31,38)(H,32,37)(H,34,35)(H,39,40)