18-[[(2S)-5-[[2-[[(2S)-3-hydroxy-1-[[2-[[(2S)-3-hydroxy-1-[[2-[(3-methyl-2-oxobutyl)amino]-2-oxoethyl]amino]-1-oxopropan-2-yl]amino]-2-oxoethyl]amino]-1-oxopropan-2-yl]amino]-2-oxoethyl]amino]-1,5-dioxopentan-2-yl]amino]-18-oxooctadecanoic acid;uranium

C40H68N7O13U- — CID 157242960

About 18-[[(2S)-5-[[2-[[(2S)-3-hydroxy-1-[[2-[[(2S)-3-hydroxy-1-[[2-[(3-methyl-2-oxobutyl)amino]-2-oxoethyl]amino]-1-oxopropan-2-yl]amino]-2-oxoethyl]amino]-1-oxopropan-2-yl]amino]-2-oxoethyl]amino]-1,5-dioxopentan-2-yl]amino]-18-oxooctadecanoic acid;uranium

18-[[(2S)-5-[[2-[[(2S)-3-hydroxy-1-[[2-[[(2S)-3-hydroxy-1-[[2-[(3-methyl-2-oxobutyl)amino]-2-oxoethyl]amino]-1-oxopropan-2-yl]amino]-2-oxoethyl]amino]-1-oxopropan-2-yl]amino]-2-oxoethyl]amino]-1,5-dioxopentan-2-yl]amino]-18-oxooctadecanoic acid;uranium (PubChem CID 157242960) has the molecular formula C40H68N7O13U- and a molecular weight of 1093.05 g/mol. Its IUPAC name is 18-[[(2S)-5-[[2-[[(2S)-3-hydroxy-1-[[2-[[(2S)-3-hydroxy-1-[[2-[(3-methyl-2-oxobutyl)amino]-2-oxoethyl]amino]-1-oxopropan-2-yl]amino]-2-oxoethyl]amino]-1-oxopropan-2-yl]amino]-2-oxoethyl]amino]-1,5-dioxopentan-2-yl]amino]-18-oxooctadecanoic acid;uranium.

Molecular Properties

• Compound Name: 18-[[(2S)-5-[[2-[[(2S)-3-hydroxy-1-[[2-[[(2S)-3-hydroxy-1-[[2-[(3-methyl-2-oxobutyl)amino]-2-oxoethyl]amino]-1-oxopropan-2-yl]amino]-2-oxoethyl]amino]-1-oxopropan-2-yl]amino]-2-oxoethyl]amino]-1,5-dioxopentan-2-yl]amino]-18-oxooctadecanoic acid;uranium
• PubChem CID: 157242960
• Molecular Formula: C40H68N7O13U-
• Molecular Weight: 1093.05 g/mol
• Exact Mass: 1092.54
• IUPAC Name: 18-[[(2S)-5-[[2-[[(2S)-3-hydroxy-1-[[2-[[(2S)-3-hydroxy-1-[[2-[(3-methyl-2-oxobutyl)amino]-2-oxoethyl]amino]-1-oxopropan-2-yl]amino]-2-oxoethyl]amino]-1-oxopropan-2-yl]amino]-2-oxoethyl]amino]-1,5-dioxopentan-2-yl]amino]-18-oxooctadecanoic acid;uranium
• SMILES: CC(C)C(=O)CNC(=O)CNC(=O)[C@H](CO)NC(=O)CNC(=O)[C@H](CO)NC(=O)CNC(=O)CC[C@@H]([C-]=O)NC(=O)CCCCCCCCCCCCCCCCC(=O)O.[U]
• InChI: InChI=1S/C40H68N7O13.U/c1-28(2)32(51)21-41-35(54)22-43-39(59)30(26-49)47-37(56)24-44-40(60)31(27-50)46-36(55)23-42-33(52)20-19-29(25-48)45-34(53)17-15-13-11-9-7-5-3-4-6-8-10-12-14-16-18-38(57)58;/h28-31,49-50H,3-24,26-27H2,1-2H3,(H,41,54)(H,42,52)(H,43,59)(H,44,60)(H,45,53)(H,46,55)(H,47,56)(H,57,58);/q-1;/t29-,30-,31-;/m0./s1
• InChIKey: RTBKOLZMOBDJQZ-OYYGHALTSA-N
• XLogP: -0.67
• TPSA: 315.60 Ų
• H-Bond Donors: 10
• H-Bond Acceptors: 12
• Rotatable Bonds: 37
• Heavy Atoms: 61
• Complexity: —

Lipinski Rule of Five

3 violations

Rule	Value
MW ≤ 500	1093.05
LogP ≤ 5	-0.67
H-Bond Donors ≤ 5	10
H-Bond Acceptors ≤ 10	12

Computed Properties (RDKit)

• Structural Alerts: {'alert_name': 'Aliphatic_long_chain', 'substructure': 'N/A'}, {'alert_name': 'Carbo_cation/anion', 'substructure': 'N/A'}

Frequently Asked Questions

What is the IUPAC name of 18-[[(2S)-5-[[2-[[(2S)-3-hydroxy-1-[[2-[[(2S)-3-hydroxy-1-[[2-[(3-methyl-2-oxobutyl)amino]-2-oxoethyl]amino]-1-oxopropan-2-yl]amino]-2-oxoethyl]amino]-1-oxopropan-2-yl]amino]-2-oxoethyl]amino]-1,5-dioxopentan-2-yl]amino]-18-oxooctadecanoic acid;uranium?

The IUPAC name of 18-[[(2S)-5-[[2-[[(2S)-3-hydroxy-1-[[2-[[(2S)-3-hydroxy-1-[[2-[(3-methyl-2-oxobutyl)amino]-2-oxoethyl]amino]-1-oxopropan-2-yl]amino]-2-oxoethyl]amino]-1-oxopropan-2-yl]amino]-2-oxoethyl]amino]-1,5-dioxopentan-2-yl]amino]-18-oxooctadecanoic acid;uranium (CID 157242960) is 18-[[(2S)-5-[[2-[[(2S)-3-hydroxy-1-[[2-[[(2S)-3-hydroxy-1-[[2-[(3-methyl-2-oxobutyl)amino]-2-oxoethyl]amino]-1-oxopropan-2-yl]amino]-2-oxoethyl]amino]-1-oxopropan-2-yl]amino]-2-oxoethyl]amino]-1,5-dioxopentan-2-yl]amino]-18-oxooctadecanoic acid;uranium.

What is the SMILES notation for 18-[[(2S)-5-[[2-[[(2S)-3-hydroxy-1-[[2-[[(2S)-3-hydroxy-1-[[2-[(3-methyl-2-oxobutyl)amino]-2-oxoethyl]amino]-1-oxopropan-2-yl]amino]-2-oxoethyl]amino]-1-oxopropan-2-yl]amino]-2-oxoethyl]amino]-1,5-dioxopentan-2-yl]amino]-18-oxooctadecanoic acid;uranium?

The canonical SMILES for 18-[[(2S)-5-[[2-[[(2S)-3-hydroxy-1-[[2-[[(2S)-3-hydroxy-1-[[2-[(3-methyl-2-oxobutyl)amino]-2-oxoethyl]amino]-1-oxopropan-2-yl]amino]-2-oxoethyl]amino]-1-oxopropan-2-yl]amino]-2-oxoethyl]amino]-1,5-dioxopentan-2-yl]amino]-18-oxooctadecanoic acid;uranium is CC(C)C(=O)CNC(=O)CNC(=O)[C@H](CO)NC(=O)CNC(=O)[C@H](CO)NC(=O)CNC(=O)CC[C@@H]([C-]=O)NC(=O)CCCCCCCCCCCCCCCCC(=O)O.[U].

What is the InChIKey of 18-[[(2S)-5-[[2-[[(2S)-3-hydroxy-1-[[2-[[(2S)-3-hydroxy-1-[[2-[(3-methyl-2-oxobutyl)amino]-2-oxoethyl]amino]-1-oxopropan-2-yl]amino]-2-oxoethyl]amino]-1-oxopropan-2-yl]amino]-2-oxoethyl]amino]-1,5-dioxopentan-2-yl]amino]-18-oxooctadecanoic acid;uranium?

The InChIKey is RTBKOLZMOBDJQZ-OYYGHALTSA-N. The full InChI is InChI=1S/C40H68N7O13.U/c1-28(2)32(51)21-41-35(54)22-43-39(59)30(26-49)47-37(56)24-44-40(60)31(27-50)46-36(55)23-42-33(52)20-19-29(25-48)45-34(53)17-15-13-11-9-7-5-3-4-6-8-10-12-14-16-18-38(57)58;/h28-31,49-50H,3-24,26-27H2,1-2H3,(H,41,54)(H,42,52)(H,43,59)(H,44,60)(H,45,53)(H,46,55)(H,47,56)(H,57,58);/q-1;/t29-,30-,31-;/m0./s1.

What are the key properties of 18-[[(2S)-5-[[2-[[(2S)-3-hydroxy-1-[[2-[[(2S)-3-hydroxy-1-[[2-[(3-methyl-2-oxobutyl)amino]-2-oxoethyl]amino]-1-oxopropan-2-yl]amino]-2-oxoethyl]amino]-1-oxopropan-2-yl]amino]-2-oxoethyl]amino]-1,5-dioxopentan-2-yl]amino]-18-oxooctadecanoic acid;uranium?

18-[[(2S)-5-[[2-[[(2S)-3-hydroxy-1-[[2-[[(2S)-3-hydroxy-1-[[2-[(3-methyl-2-oxobutyl)amino]-2-oxoethyl]amino]-1-oxopropan-2-yl]amino]-2-oxoethyl]amino]-1-oxopropan-2-yl]amino]-2-oxoethyl]amino]-1,5-dioxopentan-2-yl]amino]-18-oxooctadecanoic acid;uranium has a molecular weight of 1093.05 g/mol, XLogP of -0.67, 37 rotatable bonds, 10 hydrogen bond donors, and 12 hydrogen bond acceptors.

Where does this data come from?

All data for 18-[[(2S)-5-[[2-[[(2S)-3-hydroxy-1-[[2-[[(2S)-3-hydroxy-1-[[2-[(3-methyl-2-oxobutyl)amino]-2-oxoethyl]amino]-1-oxopropan-2-yl]amino]-2-oxoethyl]amino]-1-oxopropan-2-yl]amino]-2-oxoethyl]amino]-1,5-dioxopentan-2-yl]amino]-18-oxooctadecanoic acid;uranium is sourced from PubChem (CID 157242960), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).