(2S)-5-amino-2-[[(2S)-2-[[(2S)-5-amino-2-[[(2S)-2-[[(2S)-5-amino-2-[[(2S)-2-[[(2S)-2,5-diamino-5-oxopentanoyl]-methylamino]propanoyl]amino]-5-oxopentanoyl]-methylamino]propanoyl]amino]-5-oxopentanoyl]-methylamino]propanoyl]amino]-5-oxopentanoic acid

C32H55N11O12 — CID 10212691

About (2S)-5-amino-2-[[(2S)-2-[[(2S)-5-amino-2-[[(2S)-2-[[(2S)-5-amino-2-[[(2S)-2-[[(2S)-2,5-diamino-5-oxopentanoyl]-methylamino]propanoyl]amino]-5-oxopentanoyl]-methylamino]propanoyl]amino]-5-oxopentanoyl]-methylamino]propanoyl]amino]-5-oxopentanoic acid

(2S)-5-amino-2-[[(2S)-2-[[(2S)-5-amino-2-[[(2S)-2-[[(2S)-5-amino-2-[[(2S)-2-[[(2S)-2,5-diamino-5-oxopentanoyl]-methylamino]propanoyl]amino]-5-oxopentanoyl]-methylamino]propanoyl]amino]-5-oxopentanoyl]-methylamino]propanoyl]amino]-5-oxopentanoic acid (PubChem CID 10212691) has the molecular formula C32H55N11O12 and a molecular weight of 785.86 g/mol. Its IUPAC name is (2S)-5-amino-2-[[(2S)-2-[[(2S)-5-amino-2-[[(2S)-2-[[(2S)-5-amino-2-[[(2S)-2-[[(2S)-2,5-diamino-5-oxopentanoyl]-methylamino]propanoyl]amino]-5-oxopentanoyl]-methylamino]propanoyl]amino]-5-oxopentanoyl]-methylamino]propanoyl]amino]-5-oxopentanoic acid.

Molecular Properties

• Compound Name: (2S)-5-amino-2-[[(2S)-2-[[(2S)-5-amino-2-[[(2S)-2-[[(2S)-5-amino-2-[[(2S)-2-[[(2S)-2,5-diamino-5-oxopentanoyl]-methylamino]propanoyl]amino]-5-oxopentanoyl]-methylamino]propanoyl]amino]-5-oxopentanoyl]-methylamino]propanoyl]amino]-5-oxopentanoic acid
• PubChem CID: 10212691
• Molecular Formula: C32H55N11O12
• Molecular Weight: 785.86 g/mol
• Exact Mass: 785.40
• IUPAC Name: (2S)-5-amino-2-[[(2S)-2-[[(2S)-5-amino-2-[[(2S)-2-[[(2S)-5-amino-2-[[(2S)-2-[[(2S)-2,5-diamino-5-oxopentanoyl]-methylamino]propanoyl]amino]-5-oxopentanoyl]-methylamino]propanoyl]amino]-5-oxopentanoyl]-methylamino]propanoyl]amino]-5-oxopentanoic acid
• SMILES: C[C@@H](C(=O)N[C@@H](CCC(N)=O)C(=O)O)N(C)C(=O)[C@H](CCC(N)=O)NC(=O)[C@H](C)N(C)C(=O)[C@H](CCC(N)=O)NC(=O)[C@H](C)N(C)C(=O)[C@@H](N)CCC(N)=O
• InChI: InChI=1S/C32H55N11O12/c1-15(41(4)29(51)18(33)7-11-22(34)44)26(48)38-19(8-12-23(35)45)30(52)42(5)16(2)27(49)39-20(9-13-24(36)46)31(53)43(6)17(3)28(50)40-21(32(54)55)10-14-25(37)47/h15-21H,7-14,33H2,1-6H3,(H2,34,44)(H2,35,45)(H2,36,46)(H2,37,47)(H,38,48)(H,39,49)(H,40,50)(H,54,55)/t15-,16-,17-,18-,19-,20-,21-/m0/s1
• InChIKey: LKHSQNMBEYIFEP-BPSSIEEOSA-N
• XLogP: -5.54
• TPSA: 383.91 Ų
• H-Bond Donors: 9
• H-Bond Acceptors: 12
• Rotatable Bonds: 25
• Heavy Atoms: 55
• Complexity: —

Lipinski Rule of Five

3 violations

Rule	Value
MW ≤ 500	785.86
LogP ≤ 5	-5.54
H-Bond Donors ≤ 5	9
H-Bond Acceptors ≤ 10	12

Frequently Asked Questions

What is the IUPAC name of (2S)-5-amino-2-[[(2S)-2-[[(2S)-5-amino-2-[[(2S)-2-[[(2S)-5-amino-2-[[(2S)-2-[[(2S)-2,5-diamino-5-oxopentanoyl]-methylamino]propanoyl]amino]-5-oxopentanoyl]-methylamino]propanoyl]amino]-5-oxopentanoyl]-methylamino]propanoyl]amino]-5-oxopentanoic acid?

The IUPAC name of (2S)-5-amino-2-[[(2S)-2-[[(2S)-5-amino-2-[[(2S)-2-[[(2S)-5-amino-2-[[(2S)-2-[[(2S)-2,5-diamino-5-oxopentanoyl]-methylamino]propanoyl]amino]-5-oxopentanoyl]-methylamino]propanoyl]amino]-5-oxopentanoyl]-methylamino]propanoyl]amino]-5-oxopentanoic acid (CID 10212691) is (2S)-5-amino-2-[[(2S)-2-[[(2S)-5-amino-2-[[(2S)-2-[[(2S)-5-amino-2-[[(2S)-2-[[(2S)-2,5-diamino-5-oxopentanoyl]-methylamino]propanoyl]amino]-5-oxopentanoyl]-methylamino]propanoyl]amino]-5-oxopentanoyl]-methylamino]propanoyl]amino]-5-oxopentanoic acid.

What is the SMILES notation for (2S)-5-amino-2-[[(2S)-2-[[(2S)-5-amino-2-[[(2S)-2-[[(2S)-5-amino-2-[[(2S)-2-[[(2S)-2,5-diamino-5-oxopentanoyl]-methylamino]propanoyl]amino]-5-oxopentanoyl]-methylamino]propanoyl]amino]-5-oxopentanoyl]-methylamino]propanoyl]amino]-5-oxopentanoic acid?

The canonical SMILES for (2S)-5-amino-2-[[(2S)-2-[[(2S)-5-amino-2-[[(2S)-2-[[(2S)-5-amino-2-[[(2S)-2-[[(2S)-2,5-diamino-5-oxopentanoyl]-methylamino]propanoyl]amino]-5-oxopentanoyl]-methylamino]propanoyl]amino]-5-oxopentanoyl]-methylamino]propanoyl]amino]-5-oxopentanoic acid is C[C@@H](C(=O)N[C@@H](CCC(N)=O)C(=O)O)N(C)C(=O)[C@H](CCC(N)=O)NC(=O)[C@H](C)N(C)C(=O)[C@H](CCC(N)=O)NC(=O)[C@H](C)N(C)C(=O)[C@@H](N)CCC(N)=O.

What is the InChIKey of (2S)-5-amino-2-[[(2S)-2-[[(2S)-5-amino-2-[[(2S)-2-[[(2S)-5-amino-2-[[(2S)-2-[[(2S)-2,5-diamino-5-oxopentanoyl]-methylamino]propanoyl]amino]-5-oxopentanoyl]-methylamino]propanoyl]amino]-5-oxopentanoyl]-methylamino]propanoyl]amino]-5-oxopentanoic acid?

The InChIKey is LKHSQNMBEYIFEP-BPSSIEEOSA-N. The full InChI is InChI=1S/C32H55N11O12/c1-15(41(4)29(51)18(33)7-11-22(34)44)26(48)38-19(8-12-23(35)45)30(52)42(5)16(2)27(49)39-20(9-13-24(36)46)31(53)43(6)17(3)28(50)40-21(32(54)55)10-14-25(37)47/h15-21H,7-14,33H2,1-6H3,(H2,34,44)(H2,35,45)(H2,36,46)(H2,37,47)(H,38,48)(H,39,49)(H,40,50)(H,54,55)/t15-,16-,17-,18-,19-,20-,21-/m0/s1.

What are the key properties of (2S)-5-amino-2-[[(2S)-2-[[(2S)-5-amino-2-[[(2S)-2-[[(2S)-5-amino-2-[[(2S)-2-[[(2S)-2,5-diamino-5-oxopentanoyl]-methylamino]propanoyl]amino]-5-oxopentanoyl]-methylamino]propanoyl]amino]-5-oxopentanoyl]-methylamino]propanoyl]amino]-5-oxopentanoic acid?

(2S)-5-amino-2-[[(2S)-2-[[(2S)-5-amino-2-[[(2S)-2-[[(2S)-5-amino-2-[[(2S)-2-[[(2S)-2,5-diamino-5-oxopentanoyl]-methylamino]propanoyl]amino]-5-oxopentanoyl]-methylamino]propanoyl]amino]-5-oxopentanoyl]-methylamino]propanoyl]amino]-5-oxopentanoic acid has a molecular weight of 785.86 g/mol, XLogP of -5.54, 25 rotatable bonds, 9 hydrogen bond donors, and 12 hydrogen bond acceptors.

Where does this data come from?

All data for (2S)-5-amino-2-[[(2S)-2-[[(2S)-5-amino-2-[[(2S)-2-[[(2S)-5-amino-2-[[(2S)-2-[[(2S)-2,5-diamino-5-oxopentanoyl]-methylamino]propanoyl]amino]-5-oxopentanoyl]-methylamino]propanoyl]amino]-5-oxopentanoyl]-methylamino]propanoyl]amino]-5-oxopentanoic acid is sourced from PubChem (CID 10212691), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).