[(2R)-2-[[(2R,5S)-9-amino-5-[[(2S,5S)-5-[[(5S,8R,11S)-11-[[(2S)-2-amino-5-(diaminomethylideneamino)pentanoyl]amino]-8-(1H-imidazol-5-ylmethyl)-12-methyl-5-(2-methylsulfanylethyl)-4,7,10-trioxo-2-propan-2-yltetradecanoyl]amino]-2-(hydroxymethyl)-6-(4-hydroxyphenyl)-4-oxohexanoyl]amino]-2-[3-(diaminomethylideneamino)propyl]-4-oxononanoyl]amino]propyl] dihydrogen phosphate;(2R,5S)-5-[[(2S,5S)-5-[[(2R,5S)-5-[[(5S)-5-[[(2S)-1-[(2S)-6-amino-2-(4-oxopentanoylamino)hexanoyl]pyrrolidine-2-carbonyl]amino]-8-(diaminomethylideneamino)-4-oxooctanoyl]amino]-6-(4-hydroxyphenyl)-2-methyl-4-oxohexanoyl]amino]-2-butan-2-yl-4-oxo-6-phenylhexanoyl]amino]-2-[(4-methylphenyl)methyl]-4-oxooctanedioic acid

C130H199N24O31PS — CID 162153104

About [(2R)-2-[[(2R,5S)-9-amino-5-[[(2S,5S)-5-[[(5S,8R,11S)-11-[[(2S)-2-amino-5-(diaminomethylideneamino)pentanoyl]amino]-8-(1H-imidazol-5-ylmethyl)-12-methyl-5-(2-methylsulfanylethyl)-4,7,10-trioxo-2-propan-2-yltetradecanoyl]amino]-2-(hydroxymethyl)-6-(4-hydroxyphenyl)-4-oxohexanoyl]amino]-2-[3-(diaminomethylideneamino)propyl]-4-oxononanoyl]amino]propyl] dihydrogen phosphate;(2R,5S)-5-[[(2S,5S)-5-[[(2R,5S)-5-[[(5S)-5-[[(2S)-1-[(2S)-6-amino-2-(4-oxopentanoylamino)hexanoyl]pyrrolidine-2-carbonyl]amino]-8-(diaminomethylideneamino)-4-oxooctanoyl]amino]-6-(4-hydroxyphenyl)-2-methyl-4-oxohexanoyl]amino]-2-butan-2-yl-4-oxo-6-phenylhexanoyl]amino]-2-[(4-methylphenyl)methyl]-4-oxooctanedioic acid

[(2R)-2-[[(2R,5S)-9-amino-5-[[(2S,5S)-5-[[(5S,8R,11S)-11-[[(2S)-2-amino-5-(diaminomethylideneamino)pentanoyl]amino]-8-(1H-imidazol-5-ylmethyl)-12-methyl-5-(2-methylsulfanylethyl)-4,7,10-trioxo-2-propan-2-yltetradecanoyl]amino]-2-(hydroxymethyl)-6-(4-hydroxyphenyl)-4-oxohexanoyl]amino]-2-[3-(diaminomethylideneamino)propyl]-4-oxononanoyl]amino]propyl] dihydrogen phosphate;(2R,5S)-5-[[(2S,5S)-5-[[(2R,5S)-5-[[(5S)-5-[[(2S)-1-[(2S)-6-amino-2-(4-oxopentanoylamino)hexanoyl]pyrrolidine-2-carbonyl]amino]-8-(diaminomethylideneamino)-4-oxooctanoyl]amino]-6-(4-hydroxyphenyl)-2-methyl-4-oxohexanoyl]amino]-2-butan-2-yl-4-oxo-6-phenylhexanoyl]amino]-2-[(4-methylphenyl)methyl]-4-oxooctanedioic acid (PubChem CID 162153104) has the molecular formula C130H199N24O31PS and a molecular weight of 2657.20 g/mol. Its IUPAC name is [(2R)-2-[[(2R,5S)-9-amino-5-[[(2S,5S)-5-[[(5S,8R,11S)-11-[[(2S)-2-amino-5-(diaminomethylideneamino)pentanoyl]amino]-8-(1H-imidazol-5-ylmethyl)-12-methyl-5-(2-methylsulfanylethyl)-4,7,10-trioxo-2-propan-2-yltetradecanoyl]amino]-2-(hydroxymethyl)-6-(4-hydroxyphenyl)-4-oxohexanoyl]amino]-2-[3-(diaminomethylideneamino)propyl]-4-oxononanoyl]amino]propyl] dihydrogen phosphate;(2R,5S)-5-[[(2S,5S)-5-[[(2R,5S)-5-[[(5S)-5-[[(2S)-1-[(2S)-6-amino-2-(4-oxopentanoylamino)hexanoyl]pyrrolidine-2-carbonyl]amino]-8-(diaminomethylideneamino)-4-oxooctanoyl]amino]-6-(4-hydroxyphenyl)-2-methyl-4-oxohexanoyl]amino]-2-butan-2-yl-4-oxo-6-phenylhexanoyl]amino]-2-[(4-methylphenyl)methyl]-4-oxooctanedioic acid.

Molecular Properties

• Compound Name: [(2R)-2-[[(2R,5S)-9-amino-5-[[(2S,5S)-5-[[(5S,8R,11S)-11-[[(2S)-2-amino-5-(diaminomethylideneamino)pentanoyl]amino]-8-(1H-imidazol-5-ylmethyl)-12-methyl-5-(2-methylsulfanylethyl)-4,7,10-trioxo-2-propan-2-yltetradecanoyl]amino]-2-(hydroxymethyl)-6-(4-hydroxyphenyl)-4-oxohexanoyl]amino]-2-[3-(diaminomethylideneamino)propyl]-4-oxononanoyl]amino]propyl] dihydrogen phosphate;(2R,5S)-5-[[(2S,5S)-5-[[(2R,5S)-5-[[(5S)-5-[[(2S)-1-[(2S)-6-amino-2-(4-oxopentanoylamino)hexanoyl]pyrrolidine-2-carbonyl]amino]-8-(diaminomethylideneamino)-4-oxooctanoyl]amino]-6-(4-hydroxyphenyl)-2-methyl-4-oxohexanoyl]amino]-2-butan-2-yl-4-oxo-6-phenylhexanoyl]amino]-2-[(4-methylphenyl)methyl]-4-oxooctanedioic acid
• PubChem CID: 162153104
• Molecular Formula: C130H199N24O31PS
• Molecular Weight: 2657.20 g/mol
• Exact Mass: 2655.42
• IUPAC Name: [(2R)-2-[[(2R,5S)-9-amino-5-[[(2S,5S)-5-[[(5S,8R,11S)-11-[[(2S)-2-amino-5-(diaminomethylideneamino)pentanoyl]amino]-8-(1H-imidazol-5-ylmethyl)-12-methyl-5-(2-methylsulfanylethyl)-4,7,10-trioxo-2-propan-2-yltetradecanoyl]amino]-2-(hydroxymethyl)-6-(4-hydroxyphenyl)-4-oxohexanoyl]amino]-2-[3-(diaminomethylideneamino)propyl]-4-oxononanoyl]amino]propyl] dihydrogen phosphate;(2R,5S)-5-[[(2S,5S)-5-[[(2R,5S)-5-[[(5S)-5-[[(2S)-1-[(2S)-6-amino-2-(4-oxopentanoylamino)hexanoyl]pyrrolidine-2-carbonyl]amino]-8-(diaminomethylideneamino)-4-oxooctanoyl]amino]-6-(4-hydroxyphenyl)-2-methyl-4-oxohexanoyl]amino]-2-butan-2-yl-4-oxo-6-phenylhexanoyl]amino]-2-[(4-methylphenyl)methyl]-4-oxooctanedioic acid
• SMILES: CCC(C)[C@H](CC(=O)[C@H](Cc1ccccc1)NC(=O)[C@H](C)CC(=O)[C@H](Cc1ccc(O)cc1)NC(=O)CCC(=O)[C@H](CCCN=C(N)N)NC(=O)[C@@H]1CCCN1C(=O)[C@H](CCCCN)NC(=O)CCC(C)=O)C(=O)N[C@@H](CCC(=O)O)C(=O)C[C@@H](Cc1ccc(C)cc1)C(=O)O.CCC(C)[C@H](NC(=O)[C@@H](N)CCCN=C(N)N)C(=O)C[C@@H](Cc1cnc[nH]1)C(=O)C[C@@H](CCSC)C(=O)CC(C(=O)N[C@@H](Cc1ccc(O)cc1)C(=O)C[C@@H](CO)C(=O)N[C@@H](CCCCN)C(=O)C[C@@H](CCCN=C(N)N)C(=O)N[C@H](C)COP(=O)(O)O)C(C)C
• InChI: InChI=1S/C70H98N10O16.C60H101N14O15PS/c1-6-43(3)51(66(92)77-53(28-32-64(89)90)60(85)40-49(69(95)96)37-47-22-19-42(2)20-23-47)41-61(86)56(38-46-14-8-7-9-15-46)79-65(91)44(4)36-59(84)55(39-48-24-26-50(82)27-25-48)76-63(88)31-29-58(83)52(17-12-34-74-70(72)73)78-67(93)57-18-13-35-80(57)68(94)54(16-10-11-33-71)75-62(87)30-21-45(5)81;1-7-36(4)54(74-58(85)46(62)13-11-22-69-60(65)66)53(81)28-41(25-43-31-67-34-70-43)49(77)26-39(19-23-91-6)50(78)30-45(35(2)3)57(84)73-48(24-38-15-17-44(76)18-16-38)52(80)29-42(32-75)56(83)72-47(14-8-9-20-61)51(79)27-40(12-10-21-68-59(63)64)55(82)71-37(5)33-89-90(86,87)88/h7-9,14-15,19-20,22-27,43-44,49,51-57,82H,6,10-13,16-18,21,28-41,71H2,1-5H3,(H,75,87)(H,76,88)(H,77,92)(H,78,93)(H,79,91)(H,89,90)(H,95,96)(H4,72,73,74);15-18,31,34-37,39-42,45-48,54,75-76H,7-14,19-30,32-33,61-62H2,1-6H3,(H,67,70)(H,71,82)(H,72,83)(H,73,84)(H,74,85)(H4,63,64,68)(H4,65,66,69)(H2,86,87,88)/t43?,44-,49-,51+,52+,53+,54+,55+,56+,57+;36?,37-,39-,40-,41-,42+,45?,46+,47+,48+,54+/m11/s1
• InChIKey: ZLLWWMWYXHQHES-JJJJPPETSA-N
• XLogP: 4.64
• TPSA: 954.90 Ų
• H-Bond Donors: 26
• H-Bond Acceptors: 35
• Rotatable Bonds: 94
• Heavy Atoms: 187
• Complexity: —

Lipinski Rule of Five

3 violations

Rule	Value
MW ≤ 500	2657.20
LogP ≤ 5	4.64
H-Bond Donors ≤ 5	26
H-Bond Acceptors ≤ 10	35

Computed Properties (RDKit)

• Structural Alerts: {'alert_name': 'Aliphatic_long_chain', 'substructure': 'N/A'}, {'alert_name': 'imine_1', 'substructure': 'N/A'}, {'alert_name': 'imine_2', 'substructure': 'N/A'}, {'alert_name': 'phosphor', 'substructure': 'N/A'}

Frequently Asked Questions

What is the IUPAC name of [(2R)-2-[[(2R,5S)-9-amino-5-[[(2S,5S)-5-[[(5S,8R,11S)-11-[[(2S)-2-amino-5-(diaminomethylideneamino)pentanoyl]amino]-8-(1H-imidazol-5-ylmethyl)-12-methyl-5-(2-methylsulfanylethyl)-4,7,10-trioxo-2-propan-2-yltetradecanoyl]amino]-2-(hydroxymethyl)-6-(4-hydroxyphenyl)-4-oxohexanoyl]amino]-2-[3-(diaminomethylideneamino)propyl]-4-oxononanoyl]amino]propyl] dihydrogen phosphate;(2R,5S)-5-[[(2S,5S)-5-[[(2R,5S)-5-[[(5S)-5-[[(2S)-1-[(2S)-6-amino-2-(4-oxopentanoylamino)hexanoyl]pyrrolidine-2-carbonyl]amino]-8-(diaminomethylideneamino)-4-oxooctanoyl]amino]-6-(4-hydroxyphenyl)-2-methyl-4-oxohexanoyl]amino]-2-butan-2-yl-4-oxo-6-phenylhexanoyl]amino]-2-[(4-methylphenyl)methyl]-4-oxooctanedioic acid?

The IUPAC name of [(2R)-2-[[(2R,5S)-9-amino-5-[[(2S,5S)-5-[[(5S,8R,11S)-11-[[(2S)-2-amino-5-(diaminomethylideneamino)pentanoyl]amino]-8-(1H-imidazol-5-ylmethyl)-12-methyl-5-(2-methylsulfanylethyl)-4,7,10-trioxo-2-propan-2-yltetradecanoyl]amino]-2-(hydroxymethyl)-6-(4-hydroxyphenyl)-4-oxohexanoyl]amino]-2-[3-(diaminomethylideneamino)propyl]-4-oxononanoyl]amino]propyl] dihydrogen phosphate;(2R,5S)-5-[[(2S,5S)-5-[[(2R,5S)-5-[[(5S)-5-[[(2S)-1-[(2S)-6-amino-2-(4-oxopentanoylamino)hexanoyl]pyrrolidine-2-carbonyl]amino]-8-(diaminomethylideneamino)-4-oxooctanoyl]amino]-6-(4-hydroxyphenyl)-2-methyl-4-oxohexanoyl]amino]-2-butan-2-yl-4-oxo-6-phenylhexanoyl]amino]-2-[(4-methylphenyl)methyl]-4-oxooctanedioic acid (CID 162153104) is [(2R)-2-[[(2R,5S)-9-amino-5-[[(2S,5S)-5-[[(5S,8R,11S)-11-[[(2S)-2-amino-5-(diaminomethylideneamino)pentanoyl]amino]-8-(1H-imidazol-5-ylmethyl)-12-methyl-5-(2-methylsulfanylethyl)-4,7,10-trioxo-2-propan-2-yltetradecanoyl]amino]-2-(hydroxymethyl)-6-(4-hydroxyphenyl)-4-oxohexanoyl]amino]-2-[3-(diaminomethylideneamino)propyl]-4-oxononanoyl]amino]propyl] dihydrogen phosphate;(2R,5S)-5-[[(2S,5S)-5-[[(2R,5S)-5-[[(5S)-5-[[(2S)-1-[(2S)-6-amino-2-(4-oxopentanoylamino)hexanoyl]pyrrolidine-2-carbonyl]amino]-8-(diaminomethylideneamino)-4-oxooctanoyl]amino]-6-(4-hydroxyphenyl)-2-methyl-4-oxohexanoyl]amino]-2-butan-2-yl-4-oxo-6-phenylhexanoyl]amino]-2-[(4-methylphenyl)methyl]-4-oxooctanedioic acid.

What is the SMILES notation for [(2R)-2-[[(2R,5S)-9-amino-5-[[(2S,5S)-5-[[(5S,8R,11S)-11-[[(2S)-2-amino-5-(diaminomethylideneamino)pentanoyl]amino]-8-(1H-imidazol-5-ylmethyl)-12-methyl-5-(2-methylsulfanylethyl)-4,7,10-trioxo-2-propan-2-yltetradecanoyl]amino]-2-(hydroxymethyl)-6-(4-hydroxyphenyl)-4-oxohexanoyl]amino]-2-[3-(diaminomethylideneamino)propyl]-4-oxononanoyl]amino]propyl] dihydrogen phosphate;(2R,5S)-5-[[(2S,5S)-5-[[(2R,5S)-5-[[(5S)-5-[[(2S)-1-[(2S)-6-amino-2-(4-oxopentanoylamino)hexanoyl]pyrrolidine-2-carbonyl]amino]-8-(diaminomethylideneamino)-4-oxooctanoyl]amino]-6-(4-hydroxyphenyl)-2-methyl-4-oxohexanoyl]amino]-2-butan-2-yl-4-oxo-6-phenylhexanoyl]amino]-2-[(4-methylphenyl)methyl]-4-oxooctanedioic acid?

The canonical SMILES for [(2R)-2-[[(2R,5S)-9-amino-5-[[(2S,5S)-5-[[(5S,8R,11S)-11-[[(2S)-2-amino-5-(diaminomethylideneamino)pentanoyl]amino]-8-(1H-imidazol-5-ylmethyl)-12-methyl-5-(2-methylsulfanylethyl)-4,7,10-trioxo-2-propan-2-yltetradecanoyl]amino]-2-(hydroxymethyl)-6-(4-hydroxyphenyl)-4-oxohexanoyl]amino]-2-[3-(diaminomethylideneamino)propyl]-4-oxononanoyl]amino]propyl] dihydrogen phosphate;(2R,5S)-5-[[(2S,5S)-5-[[(2R,5S)-5-[[(5S)-5-[[(2S)-1-[(2S)-6-amino-2-(4-oxopentanoylamino)hexanoyl]pyrrolidine-2-carbonyl]amino]-8-(diaminomethylideneamino)-4-oxooctanoyl]amino]-6-(4-hydroxyphenyl)-2-methyl-4-oxohexanoyl]amino]-2-butan-2-yl-4-oxo-6-phenylhexanoyl]amino]-2-[(4-methylphenyl)methyl]-4-oxooctanedioic acid is CCC(C)[C@H](CC(=O)[C@H](Cc1ccccc1)NC(=O)[C@H](C)CC(=O)[C@H](Cc1ccc(O)cc1)NC(=O)CCC(=O)[C@H](CCCN=C(N)N)NC(=O)[C@@H]1CCCN1C(=O)[C@H](CCCCN)NC(=O)CCC(C)=O)C(=O)N[C@@H](CCC(=O)O)C(=O)C[C@@H](Cc1ccc(C)cc1)C(=O)O.CCC(C)[C@H](NC(=O)[C@@H](N)CCCN=C(N)N)C(=O)C[C@@H](Cc1cnc[nH]1)C(=O)C[C@@H](CCSC)C(=O)CC(C(=O)N[C@@H](Cc1ccc(O)cc1)C(=O)C[C@@H](CO)C(=O)N[C@@H](CCCCN)C(=O)C[C@@H](CCCN=C(N)N)C(=O)N[C@H](C)COP(=O)(O)O)C(C)C.

What is the InChIKey of [(2R)-2-[[(2R,5S)-9-amino-5-[[(2S,5S)-5-[[(5S,8R,11S)-11-[[(2S)-2-amino-5-(diaminomethylideneamino)pentanoyl]amino]-8-(1H-imidazol-5-ylmethyl)-12-methyl-5-(2-methylsulfanylethyl)-4,7,10-trioxo-2-propan-2-yltetradecanoyl]amino]-2-(hydroxymethyl)-6-(4-hydroxyphenyl)-4-oxohexanoyl]amino]-2-[3-(diaminomethylideneamino)propyl]-4-oxononanoyl]amino]propyl] dihydrogen phosphate;(2R,5S)-5-[[(2S,5S)-5-[[(2R,5S)-5-[[(5S)-5-[[(2S)-1-[(2S)-6-amino-2-(4-oxopentanoylamino)hexanoyl]pyrrolidine-2-carbonyl]amino]-8-(diaminomethylideneamino)-4-oxooctanoyl]amino]-6-(4-hydroxyphenyl)-2-methyl-4-oxohexanoyl]amino]-2-butan-2-yl-4-oxo-6-phenylhexanoyl]amino]-2-[(4-methylphenyl)methyl]-4-oxooctanedioic acid?

The InChIKey is ZLLWWMWYXHQHES-JJJJPPETSA-N. The full InChI is InChI=1S/C70H98N10O16.C60H101N14O15PS/c1-6-43(3)51(66(92)77-53(28-32-64(89)90)60(85)40-49(69(95)96)37-47-22-19-42(2)20-23-47)41-61(86)56(38-46-14-8-7-9-15-46)79-65(91)44(4)36-59(84)55(39-48-24-26-50(82)27-25-48)76-63(88)31-29-58(83)52(17-12-34-74-70(72)73)78-67(93)57-18-13-35-80(57)68(94)54(16-10-11-33-71)75-62(87)30-21-45(5)81;1-7-36(4)54(74-58(85)46(62)13-11-22-69-60(65)66)53(81)28-41(25-43-31-67-34-70-43)49(77)26-39(19-23-91-6)50(78)30-45(35(2)3)57(84)73-48(24-38-15-17-44(76)18-16-38)52(80)29-42(32-75)56(83)72-47(14-8-9-20-61)51(79)27-40(12-10-21-68-59(63)64)55(82)71-37(5)33-89-90(86,87)88/h7-9,14-15,19-20,22-27,43-44,49,51-57,82H,6,10-13,16-18,21,28-41,71H2,1-5H3,(H,75,87)(H,76,88)(H,77,92)(H,78,93)(H,79,91)(H,89,90)(H,95,96)(H4,72,73,74);15-18,31,34-37,39-42,45-48,54,75-76H,7-14,19-30,32-33,61-62H2,1-6H3,(H,67,70)(H,71,82)(H,72,83)(H,73,84)(H,74,85)(H4,63,64,68)(H4,65,66,69)(H2,86,87,88)/t43?,44-,49-,51+,52+,53+,54+,55+,56+,57+;36?,37-,39-,40-,41-,42+,45?,46+,47+,48+,54+/m11/s1.

What are the key properties of [(2R)-2-[[(2R,5S)-9-amino-5-[[(2S,5S)-5-[[(5S,8R,11S)-11-[[(2S)-2-amino-5-(diaminomethylideneamino)pentanoyl]amino]-8-(1H-imidazol-5-ylmethyl)-12-methyl-5-(2-methylsulfanylethyl)-4,7,10-trioxo-2-propan-2-yltetradecanoyl]amino]-2-(hydroxymethyl)-6-(4-hydroxyphenyl)-4-oxohexanoyl]amino]-2-[3-(diaminomethylideneamino)propyl]-4-oxononanoyl]amino]propyl] dihydrogen phosphate;(2R,5S)-5-[[(2S,5S)-5-[[(2R,5S)-5-[[(5S)-5-[[(2S)-1-[(2S)-6-amino-2-(4-oxopentanoylamino)hexanoyl]pyrrolidine-2-carbonyl]amino]-8-(diaminomethylideneamino)-4-oxooctanoyl]amino]-6-(4-hydroxyphenyl)-2-methyl-4-oxohexanoyl]amino]-2-butan-2-yl-4-oxo-6-phenylhexanoyl]amino]-2-[(4-methylphenyl)methyl]-4-oxooctanedioic acid?

[(2R)-2-[[(2R,5S)-9-amino-5-[[(2S,5S)-5-[[(5S,8R,11S)-11-[[(2S)-2-amino-5-(diaminomethylideneamino)pentanoyl]amino]-8-(1H-imidazol-5-ylmethyl)-12-methyl-5-(2-methylsulfanylethyl)-4,7,10-trioxo-2-propan-2-yltetradecanoyl]amino]-2-(hydroxymethyl)-6-(4-hydroxyphenyl)-4-oxohexanoyl]amino]-2-[3-(diaminomethylideneamino)propyl]-4-oxononanoyl]amino]propyl] dihydrogen phosphate;(2R,5S)-5-[[(2S,5S)-5-[[(2R,5S)-5-[[(5S)-5-[[(2S)-1-[(2S)-6-amino-2-(4-oxopentanoylamino)hexanoyl]pyrrolidine-2-carbonyl]amino]-8-(diaminomethylideneamino)-4-oxooctanoyl]amino]-6-(4-hydroxyphenyl)-2-methyl-4-oxohexanoyl]amino]-2-butan-2-yl-4-oxo-6-phenylhexanoyl]amino]-2-[(4-methylphenyl)methyl]-4-oxooctanedioic acid has a molecular weight of 2657.20 g/mol, XLogP of 4.64, 94 rotatable bonds, 26 hydrogen bond donors, and 35 hydrogen bond acceptors.

Where does this data come from?

All data for [(2R)-2-[[(2R,5S)-9-amino-5-[[(2S,5S)-5-[[(5S,8R,11S)-11-[[(2S)-2-amino-5-(diaminomethylideneamino)pentanoyl]amino]-8-(1H-imidazol-5-ylmethyl)-12-methyl-5-(2-methylsulfanylethyl)-4,7,10-trioxo-2-propan-2-yltetradecanoyl]amino]-2-(hydroxymethyl)-6-(4-hydroxyphenyl)-4-oxohexanoyl]amino]-2-[3-(diaminomethylideneamino)propyl]-4-oxononanoyl]amino]propyl] dihydrogen phosphate;(2R,5S)-5-[[(2S,5S)-5-[[(2R,5S)-5-[[(5S)-5-[[(2S)-1-[(2S)-6-amino-2-(4-oxopentanoylamino)hexanoyl]pyrrolidine-2-carbonyl]amino]-8-(diaminomethylideneamino)-4-oxooctanoyl]amino]-6-(4-hydroxyphenyl)-2-methyl-4-oxohexanoyl]amino]-2-butan-2-yl-4-oxo-6-phenylhexanoyl]amino]-2-[(4-methylphenyl)methyl]-4-oxooctanedioic acid is sourced from PubChem (CID 162153104), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).