(3S)-3-[[(2S)-3-[2-[2-[2-[2-[4-[2-[2-[[7-[2-[2-[[1-[2-[2-[2-[2-[(2S)-3-[[(1S)-2-carboxy-1-(4-naphthalen-1-ylphenyl)ethyl]amino]-2-[4-[(4-methyl-2-pyridinyl)amino]butanoylamino]-3-oxopropoxy]ethoxy]ethoxy]ethoxy]ethyl]triazol-4-yl]methoxy]ethoxy]ethylamino]-4-[3-[2-[2-[[1-[2-[2-[2-[2-[(2S)-3-[[(1S)-2-carboxy-1-(4-naphthalen-1-ylphenyl)ethyl]amino]-2-[4-[(4-methyl-2-pyridinyl)amino]butanoylamino]-3-oxopropoxy]ethoxy]ethoxy]ethoxy]ethyl]triazol-4-yl]methoxy]ethoxy]ethylamino]-3-oxopropyl]-7-oxo-4-(5-oxoheptanoylamino)heptanoyl]amino]ethoxy]ethoxymethyl]triazol-1-yl]ethoxy]ethoxy]ethoxy]ethoxy]-2-[4-[(4-methyl-2-pyridinyl)amino]butanoylamino]propanoyl]amino]-3-(4-naphthalen-1-ylphenyl)propanoic acid

C158H207N25O35 — CID 163916169

About (3S)-3-[[(2S)-3-[2-[2-[2-[2-[4-[2-[2-[[7-[2-[2-[[1-[2-[2-[2-[2-[(2S)-3-[[(1S)-2-carboxy-1-(4-naphthalen-1-ylphenyl)ethyl]amino]-2-[4-[(4-methyl-2-pyridinyl)amino]butanoylamino]-3-oxopropoxy]ethoxy]ethoxy]ethoxy]ethyl]triazol-4-yl]methoxy]ethoxy]ethylamino]-4-[3-[2-[2-[[1-[2-[2-[2-[2-[(2S)-3-[[(1S)-2-carboxy-1-(4-naphthalen-1-ylphenyl)ethyl]amino]-2-[4-[(4-methyl-2-pyridinyl)amino]butanoylamino]-3-oxopropoxy]ethoxy]ethoxy]ethoxy]ethyl]triazol-4-yl]methoxy]ethoxy]ethylamino]-3-oxopropyl]-7-oxo-4-(5-oxoheptanoylamino)heptanoyl]amino]ethoxy]ethoxymethyl]triazol-1-yl]ethoxy]ethoxy]ethoxy]ethoxy]-2-[4-[(4-methyl-2-pyridinyl)amino]butanoylamino]propanoyl]amino]-3-(4-naphthalen-1-ylphenyl)propanoic acid

(3S)-3-[[(2S)-3-[2-[2-[2-[2-[4-[2-[2-[[7-[2-[2-[[1-[2-[2-[2-[2-[(2S)-3-[[(1S)-2-carboxy-1-(4-naphthalen-1-ylphenyl)ethyl]amino]-2-[4-[(4-methyl-2-pyridinyl)amino]butanoylamino]-3-oxopropoxy]ethoxy]ethoxy]ethoxy]ethyl]triazol-4-yl]methoxy]ethoxy]ethylamino]-4-[3-[2-[2-[[1-[2-[2-[2-[2-[(2S)-3-[[(1S)-2-carboxy-1-(4-naphthalen-1-ylphenyl)ethyl]amino]-2-[4-[(4-methyl-2-pyridinyl)amino]butanoylamino]-3-oxopropoxy]ethoxy]ethoxy]ethoxy]ethyl]triazol-4-yl]methoxy]ethoxy]ethylamino]-3-oxopropyl]-7-oxo-4-(5-oxoheptanoylamino)heptanoyl]amino]ethoxy]ethoxymethyl]triazol-1-yl]ethoxy]ethoxy]ethoxy]ethoxy]-2-[4-[(4-methyl-2-pyridinyl)amino]butanoylamino]propanoyl]amino]-3-(4-naphthalen-1-ylphenyl)propanoic acid (PubChem CID 163916169) has the molecular formula C158H207N25O35 and a molecular weight of 3016.53 g/mol. Its IUPAC name is (3S)-3-[[(2S)-3-[2-[2-[2-[2-[4-[2-[2-[[7-[2-[2-[[1-[2-[2-[2-[2-[(2S)-3-[[(1S)-2-carboxy-1-(4-naphthalen-1-ylphenyl)ethyl]amino]-2-[4-[(4-methyl-2-pyridinyl)amino]butanoylamino]-3-oxopropoxy]ethoxy]ethoxy]ethoxy]ethyl]triazol-4-yl]methoxy]ethoxy]ethylamino]-4-[3-[2-[2-[[1-[2-[2-[2-[2-[(2S)-3-[[(1S)-2-carboxy-1-(4-naphthalen-1-ylphenyl)ethyl]amino]-2-[4-[(4-methyl-2-pyridinyl)amino]butanoylamino]-3-oxopropoxy]ethoxy]ethoxy]ethoxy]ethyl]triazol-4-yl]methoxy]ethoxy]ethylamino]-3-oxopropyl]-7-oxo-4-(5-oxoheptanoylamino)heptanoyl]amino]ethoxy]ethoxymethyl]triazol-1-yl]ethoxy]ethoxy]ethoxy]ethoxy]-2-[4-[(4-methyl-2-pyridinyl)amino]butanoylamino]propanoyl]amino]-3-(4-naphthalen-1-ylphenyl)propanoic acid.

Molecular Properties

• Compound Name: (3S)-3-[[(2S)-3-[2-[2-[2-[2-[4-[2-[2-[[7-[2-[2-[[1-[2-[2-[2-[2-[(2S)-3-[[(1S)-2-carboxy-1-(4-naphthalen-1-ylphenyl)ethyl]amino]-2-[4-[(4-methyl-2-pyridinyl)amino]butanoylamino]-3-oxopropoxy]ethoxy]ethoxy]ethoxy]ethyl]triazol-4-yl]methoxy]ethoxy]ethylamino]-4-[3-[2-[2-[[1-[2-[2-[2-[2-[(2S)-3-[[(1S)-2-carboxy-1-(4-naphthalen-1-ylphenyl)ethyl]amino]-2-[4-[(4-methyl-2-pyridinyl)amino]butanoylamino]-3-oxopropoxy]ethoxy]ethoxy]ethoxy]ethyl]triazol-4-yl]methoxy]ethoxy]ethylamino]-3-oxopropyl]-7-oxo-4-(5-oxoheptanoylamino)heptanoyl]amino]ethoxy]ethoxymethyl]triazol-1-yl]ethoxy]ethoxy]ethoxy]ethoxy]-2-[4-[(4-methyl-2-pyridinyl)amino]butanoylamino]propanoyl]amino]-3-(4-naphthalen-1-ylphenyl)propanoic acid
• PubChem CID: 163916169
• Molecular Formula: C158H207N25O35
• Molecular Weight: 3016.53 g/mol
• Exact Mass: 3014.52
• IUPAC Name: (3S)-3-[[(2S)-3-[2-[2-[2-[2-[4-[2-[2-[[7-[2-[2-[[1-[2-[2-[2-[2-[(2S)-3-[[(1S)-2-carboxy-1-(4-naphthalen-1-ylphenyl)ethyl]amino]-2-[4-[(4-methyl-2-pyridinyl)amino]butanoylamino]-3-oxopropoxy]ethoxy]ethoxy]ethoxy]ethyl]triazol-4-yl]methoxy]ethoxy]ethylamino]-4-[3-[2-[2-[[1-[2-[2-[2-[2-[(2S)-3-[[(1S)-2-carboxy-1-(4-naphthalen-1-ylphenyl)ethyl]amino]-2-[4-[(4-methyl-2-pyridinyl)amino]butanoylamino]-3-oxopropoxy]ethoxy]ethoxy]ethoxy]ethyl]triazol-4-yl]methoxy]ethoxy]ethylamino]-3-oxopropyl]-7-oxo-4-(5-oxoheptanoylamino)heptanoyl]amino]ethoxy]ethoxymethyl]triazol-1-yl]ethoxy]ethoxy]ethoxy]ethoxy]-2-[4-[(4-methyl-2-pyridinyl)amino]butanoylamino]propanoyl]amino]-3-(4-naphthalen-1-ylphenyl)propanoic acid
• SMILES: CCC(=O)CCCC(=O)NC(CCC(=O)NCCOCCOCc1cn(CCOCCOCCOCCOC[C@H](NC(=O)CCCNc2cc(C)ccn2)C(=O)N[C@@H](CC(=O)O)c2ccc(-c3cccc4ccccc34)cc2)nn1)(CCC(=O)NCCOCCOCc1cn(CCOCCOCCOCCOC[C@H](NC(=O)CCCNc2cc(C)ccn2)C(=O)N[C@@H](CC(=O)O)c2ccc(-c3cccc4ccccc34)cc2)nn1)CCC(=O)NCCOCCOCc1cn(CCOCCOCCOCCOC[C@H](NC(=O)CCCNc2cc(C)ccn2)C(=O)N[C@@H](CC(=O)O)c2ccc(-c3cccc4ccccc34)cc2)nn1
• InChI: InChI=1S/C158H207N25O35/c1-5-129(184)25-15-32-151(191)174-158(54-48-145(185)165-63-69-201-87-93-213-108-126-105-181(178-175-126)66-72-204-75-78-207-81-84-210-90-96-216-111-139(168-148(188)33-16-57-159-142-99-114(2)51-60-162-142)155(198)171-136(102-152(192)193)123-42-36-120(37-43-123)133-29-12-22-117-19-6-9-26-130(117)133,55-49-146(186)166-64-70-202-88-94-214-109-127-106-182(179-176-127)67-73-205-76-79-208-82-85-211-91-97-217-112-140(169-149(189)34-17-58-160-143-100-115(3)52-61-163-143)156(199)172-137(103-153(194)195)124-44-38-121(39-45-124)134-30-13-23-118-20-7-10-27-131(118)134)56-50-147(187)167-65-71-203-89-95-215-110-128-107-183(180-177-128)68-74-206-77-80-209-83-86-212-92-98-218-113-141(170-150(190)35-18-59-161-144-101-116(4)53-62-164-144)157(200)173-138(104-154(196)197)125-46-40-122(41-47-125)135-31-14-24-119-21-8-11-28-132(119)135/h6-14,19-24,26-31,36-47,51-53,60-62,99-101,105-107,136-141H,5,15-18,25,32-35,48-50,54-59,63-98,102-104,108-113H2,1-4H3,(H,159,162)(H,160,163)(H,161,164)(H,165,185)(H,166,186)(H,167,187)(H,168,188)(H,169,189)(H,170,190)(H,171,198)(H,172,199)(H,173,200)(H,174,191)(H,192,193)(H,194,195)(H,196,197)/t136-,137-,138-,139-,140-,141-/m0/s1
• InChIKey: QWKXIFIZWFJEJJ-DQRUBINHSA-N
• XLogP: 14.05
• TPSA: 753.00 Ų
• H-Bond Donors: 16
• H-Bond Acceptors: 47
• Rotatable Bonds: 117
• Heavy Atoms: 218
• Complexity: —

Lipinski Rule of Five

4 violations

Rule	Value
MW ≤ 500	3016.53
LogP ≤ 5	14.05
H-Bond Donors ≤ 5	16
H-Bond Acceptors ≤ 10	47

Computed Properties (RDKit)

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

Frequently Asked Questions

What is the IUPAC name of (3S)-3-[[(2S)-3-[2-[2-[2-[2-[4-[2-[2-[[7-[2-[2-[[1-[2-[2-[2-[2-[(2S)-3-[[(1S)-2-carboxy-1-(4-naphthalen-1-ylphenyl)ethyl]amino]-2-[4-[(4-methyl-2-pyridinyl)amino]butanoylamino]-3-oxopropoxy]ethoxy]ethoxy]ethoxy]ethyl]triazol-4-yl]methoxy]ethoxy]ethylamino]-4-[3-[2-[2-[[1-[2-[2-[2-[2-[(2S)-3-[[(1S)-2-carboxy-1-(4-naphthalen-1-ylphenyl)ethyl]amino]-2-[4-[(4-methyl-2-pyridinyl)amino]butanoylamino]-3-oxopropoxy]ethoxy]ethoxy]ethoxy]ethyl]triazol-4-yl]methoxy]ethoxy]ethylamino]-3-oxopropyl]-7-oxo-4-(5-oxoheptanoylamino)heptanoyl]amino]ethoxy]ethoxymethyl]triazol-1-yl]ethoxy]ethoxy]ethoxy]ethoxy]-2-[4-[(4-methyl-2-pyridinyl)amino]butanoylamino]propanoyl]amino]-3-(4-naphthalen-1-ylphenyl)propanoic acid?

The IUPAC name of (3S)-3-[[(2S)-3-[2-[2-[2-[2-[4-[2-[2-[[7-[2-[2-[[1-[2-[2-[2-[2-[(2S)-3-[[(1S)-2-carboxy-1-(4-naphthalen-1-ylphenyl)ethyl]amino]-2-[4-[(4-methyl-2-pyridinyl)amino]butanoylamino]-3-oxopropoxy]ethoxy]ethoxy]ethoxy]ethyl]triazol-4-yl]methoxy]ethoxy]ethylamino]-4-[3-[2-[2-[[1-[2-[2-[2-[2-[(2S)-3-[[(1S)-2-carboxy-1-(4-naphthalen-1-ylphenyl)ethyl]amino]-2-[4-[(4-methyl-2-pyridinyl)amino]butanoylamino]-3-oxopropoxy]ethoxy]ethoxy]ethoxy]ethyl]triazol-4-yl]methoxy]ethoxy]ethylamino]-3-oxopropyl]-7-oxo-4-(5-oxoheptanoylamino)heptanoyl]amino]ethoxy]ethoxymethyl]triazol-1-yl]ethoxy]ethoxy]ethoxy]ethoxy]-2-[4-[(4-methyl-2-pyridinyl)amino]butanoylamino]propanoyl]amino]-3-(4-naphthalen-1-ylphenyl)propanoic acid (CID 163916169) is (3S)-3-[[(2S)-3-[2-[2-[2-[2-[4-[2-[2-[[7-[2-[2-[[1-[2-[2-[2-[2-[(2S)-3-[[(1S)-2-carboxy-1-(4-naphthalen-1-ylphenyl)ethyl]amino]-2-[4-[(4-methyl-2-pyridinyl)amino]butanoylamino]-3-oxopropoxy]ethoxy]ethoxy]ethoxy]ethyl]triazol-4-yl]methoxy]ethoxy]ethylamino]-4-[3-[2-[2-[[1-[2-[2-[2-[2-[(2S)-3-[[(1S)-2-carboxy-1-(4-naphthalen-1-ylphenyl)ethyl]amino]-2-[4-[(4-methyl-2-pyridinyl)amino]butanoylamino]-3-oxopropoxy]ethoxy]ethoxy]ethoxy]ethyl]triazol-4-yl]methoxy]ethoxy]ethylamino]-3-oxopropyl]-7-oxo-4-(5-oxoheptanoylamino)heptanoyl]amino]ethoxy]ethoxymethyl]triazol-1-yl]ethoxy]ethoxy]ethoxy]ethoxy]-2-[4-[(4-methyl-2-pyridinyl)amino]butanoylamino]propanoyl]amino]-3-(4-naphthalen-1-ylphenyl)propanoic acid.

What is the SMILES notation for (3S)-3-[[(2S)-3-[2-[2-[2-[2-[4-[2-[2-[[7-[2-[2-[[1-[2-[2-[2-[2-[(2S)-3-[[(1S)-2-carboxy-1-(4-naphthalen-1-ylphenyl)ethyl]amino]-2-[4-[(4-methyl-2-pyridinyl)amino]butanoylamino]-3-oxopropoxy]ethoxy]ethoxy]ethoxy]ethyl]triazol-4-yl]methoxy]ethoxy]ethylamino]-4-[3-[2-[2-[[1-[2-[2-[2-[2-[(2S)-3-[[(1S)-2-carboxy-1-(4-naphthalen-1-ylphenyl)ethyl]amino]-2-[4-[(4-methyl-2-pyridinyl)amino]butanoylamino]-3-oxopropoxy]ethoxy]ethoxy]ethoxy]ethyl]triazol-4-yl]methoxy]ethoxy]ethylamino]-3-oxopropyl]-7-oxo-4-(5-oxoheptanoylamino)heptanoyl]amino]ethoxy]ethoxymethyl]triazol-1-yl]ethoxy]ethoxy]ethoxy]ethoxy]-2-[4-[(4-methyl-2-pyridinyl)amino]butanoylamino]propanoyl]amino]-3-(4-naphthalen-1-ylphenyl)propanoic acid?

The canonical SMILES for (3S)-3-[[(2S)-3-[2-[2-[2-[2-[4-[2-[2-[[7-[2-[2-[[1-[2-[2-[2-[2-[(2S)-3-[[(1S)-2-carboxy-1-(4-naphthalen-1-ylphenyl)ethyl]amino]-2-[4-[(4-methyl-2-pyridinyl)amino]butanoylamino]-3-oxopropoxy]ethoxy]ethoxy]ethoxy]ethyl]triazol-4-yl]methoxy]ethoxy]ethylamino]-4-[3-[2-[2-[[1-[2-[2-[2-[2-[(2S)-3-[[(1S)-2-carboxy-1-(4-naphthalen-1-ylphenyl)ethyl]amino]-2-[4-[(4-methyl-2-pyridinyl)amino]butanoylamino]-3-oxopropoxy]ethoxy]ethoxy]ethoxy]ethyl]triazol-4-yl]methoxy]ethoxy]ethylamino]-3-oxopropyl]-7-oxo-4-(5-oxoheptanoylamino)heptanoyl]amino]ethoxy]ethoxymethyl]triazol-1-yl]ethoxy]ethoxy]ethoxy]ethoxy]-2-[4-[(4-methyl-2-pyridinyl)amino]butanoylamino]propanoyl]amino]-3-(4-naphthalen-1-ylphenyl)propanoic acid is CCC(=O)CCCC(=O)NC(CCC(=O)NCCOCCOCc1cn(CCOCCOCCOCCOC[C@H](NC(=O)CCCNc2cc(C)ccn2)C(=O)N[C@@H](CC(=O)O)c2ccc(-c3cccc4ccccc34)cc2)nn1)(CCC(=O)NCCOCCOCc1cn(CCOCCOCCOCCOC[C@H](NC(=O)CCCNc2cc(C)ccn2)C(=O)N[C@@H](CC(=O)O)c2ccc(-c3cccc4ccccc34)cc2)nn1)CCC(=O)NCCOCCOCc1cn(CCOCCOCCOCCOC[C@H](NC(=O)CCCNc2cc(C)ccn2)C(=O)N[C@@H](CC(=O)O)c2ccc(-c3cccc4ccccc34)cc2)nn1.

What is the InChIKey of (3S)-3-[[(2S)-3-[2-[2-[2-[2-[4-[2-[2-[[7-[2-[2-[[1-[2-[2-[2-[2-[(2S)-3-[[(1S)-2-carboxy-1-(4-naphthalen-1-ylphenyl)ethyl]amino]-2-[4-[(4-methyl-2-pyridinyl)amino]butanoylamino]-3-oxopropoxy]ethoxy]ethoxy]ethoxy]ethyl]triazol-4-yl]methoxy]ethoxy]ethylamino]-4-[3-[2-[2-[[1-[2-[2-[2-[2-[(2S)-3-[[(1S)-2-carboxy-1-(4-naphthalen-1-ylphenyl)ethyl]amino]-2-[4-[(4-methyl-2-pyridinyl)amino]butanoylamino]-3-oxopropoxy]ethoxy]ethoxy]ethoxy]ethyl]triazol-4-yl]methoxy]ethoxy]ethylamino]-3-oxopropyl]-7-oxo-4-(5-oxoheptanoylamino)heptanoyl]amino]ethoxy]ethoxymethyl]triazol-1-yl]ethoxy]ethoxy]ethoxy]ethoxy]-2-[4-[(4-methyl-2-pyridinyl)amino]butanoylamino]propanoyl]amino]-3-(4-naphthalen-1-ylphenyl)propanoic acid?

The InChIKey is QWKXIFIZWFJEJJ-DQRUBINHSA-N. The full InChI is InChI=1S/C158H207N25O35/c1-5-129(184)25-15-32-151(191)174-158(54-48-145(185)165-63-69-201-87-93-213-108-126-105-181(178-175-126)66-72-204-75-78-207-81-84-210-90-96-216-111-139(168-148(188)33-16-57-159-142-99-114(2)51-60-162-142)155(198)171-136(102-152(192)193)123-42-36-120(37-43-123)133-29-12-22-117-19-6-9-26-130(117)133,55-49-146(186)166-64-70-202-88-94-214-109-127-106-182(179-176-127)67-73-205-76-79-208-82-85-211-91-97-217-112-140(169-149(189)34-17-58-160-143-100-115(3)52-61-163-143)156(199)172-137(103-153(194)195)124-44-38-121(39-45-124)134-30-13-23-118-20-7-10-27-131(118)134)56-50-147(187)167-65-71-203-89-95-215-110-128-107-183(180-177-128)68-74-206-77-80-209-83-86-212-92-98-218-113-141(170-150(190)35-18-59-161-144-101-116(4)53-62-164-144)157(200)173-138(104-154(196)197)125-46-40-122(41-47-125)135-31-14-24-119-21-8-11-28-132(119)135/h6-14,19-24,26-31,36-47,51-53,60-62,99-101,105-107,136-141H,5,15-18,25,32-35,48-50,54-59,63-98,102-104,108-113H2,1-4H3,(H,159,162)(H,160,163)(H,161,164)(H,165,185)(H,166,186)(H,167,187)(H,168,188)(H,169,189)(H,170,190)(H,171,198)(H,172,199)(H,173,200)(H,174,191)(H,192,193)(H,194,195)(H,196,197)/t136-,137-,138-,139-,140-,141-/m0/s1.

What are the key properties of (3S)-3-[[(2S)-3-[2-[2-[2-[2-[4-[2-[2-[[7-[2-[2-[[1-[2-[2-[2-[2-[(2S)-3-[[(1S)-2-carboxy-1-(4-naphthalen-1-ylphenyl)ethyl]amino]-2-[4-[(4-methyl-2-pyridinyl)amino]butanoylamino]-3-oxopropoxy]ethoxy]ethoxy]ethoxy]ethyl]triazol-4-yl]methoxy]ethoxy]ethylamino]-4-[3-[2-[2-[[1-[2-[2-[2-[2-[(2S)-3-[[(1S)-2-carboxy-1-(4-naphthalen-1-ylphenyl)ethyl]amino]-2-[4-[(4-methyl-2-pyridinyl)amino]butanoylamino]-3-oxopropoxy]ethoxy]ethoxy]ethoxy]ethyl]triazol-4-yl]methoxy]ethoxy]ethylamino]-3-oxopropyl]-7-oxo-4-(5-oxoheptanoylamino)heptanoyl]amino]ethoxy]ethoxymethyl]triazol-1-yl]ethoxy]ethoxy]ethoxy]ethoxy]-2-[4-[(4-methyl-2-pyridinyl)amino]butanoylamino]propanoyl]amino]-3-(4-naphthalen-1-ylphenyl)propanoic acid?

(3S)-3-[[(2S)-3-[2-[2-[2-[2-[4-[2-[2-[[7-[2-[2-[[1-[2-[2-[2-[2-[(2S)-3-[[(1S)-2-carboxy-1-(4-naphthalen-1-ylphenyl)ethyl]amino]-2-[4-[(4-methyl-2-pyridinyl)amino]butanoylamino]-3-oxopropoxy]ethoxy]ethoxy]ethoxy]ethyl]triazol-4-yl]methoxy]ethoxy]ethylamino]-4-[3-[2-[2-[[1-[2-[2-[2-[2-[(2S)-3-[[(1S)-2-carboxy-1-(4-naphthalen-1-ylphenyl)ethyl]amino]-2-[4-[(4-methyl-2-pyridinyl)amino]butanoylamino]-3-oxopropoxy]ethoxy]ethoxy]ethoxy]ethyl]triazol-4-yl]methoxy]ethoxy]ethylamino]-3-oxopropyl]-7-oxo-4-(5-oxoheptanoylamino)heptanoyl]amino]ethoxy]ethoxymethyl]triazol-1-yl]ethoxy]ethoxy]ethoxy]ethoxy]-2-[4-[(4-methyl-2-pyridinyl)amino]butanoylamino]propanoyl]amino]-3-(4-naphthalen-1-ylphenyl)propanoic acid has a molecular weight of 3016.53 g/mol, XLogP of 14.05, 117 rotatable bonds, 16 hydrogen bond donors, and 47 hydrogen bond acceptors.

Where does this data come from?

All data for (3S)-3-[[(2S)-3-[2-[2-[2-[2-[4-[2-[2-[[7-[2-[2-[[1-[2-[2-[2-[2-[(2S)-3-[[(1S)-2-carboxy-1-(4-naphthalen-1-ylphenyl)ethyl]amino]-2-[4-[(4-methyl-2-pyridinyl)amino]butanoylamino]-3-oxopropoxy]ethoxy]ethoxy]ethoxy]ethyl]triazol-4-yl]methoxy]ethoxy]ethylamino]-4-[3-[2-[2-[[1-[2-[2-[2-[2-[(2S)-3-[[(1S)-2-carboxy-1-(4-naphthalen-1-ylphenyl)ethyl]amino]-2-[4-[(4-methyl-2-pyridinyl)amino]butanoylamino]-3-oxopropoxy]ethoxy]ethoxy]ethoxy]ethyl]triazol-4-yl]methoxy]ethoxy]ethylamino]-3-oxopropyl]-7-oxo-4-(5-oxoheptanoylamino)heptanoyl]amino]ethoxy]ethoxymethyl]triazol-1-yl]ethoxy]ethoxy]ethoxy]ethoxy]-2-[4-[(4-methyl-2-pyridinyl)amino]butanoylamino]propanoyl]amino]-3-(4-naphthalen-1-ylphenyl)propanoic acid is sourced from PubChem (CID 163916169), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).