H-Phe-Ile-Thr-Val-His-NH2

Details

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Internal ID 6b4c1b37-617f-47bf-8ebb-318026c75a22
Taxonomy Organic acids and derivatives > Carboxylic acids and derivatives > Amino acids, peptides, and analogues > Peptides > Oligopeptides
IUPAC Name (2S,3S)-N-[(2S,3R)-1-[[(2S)-1-[[(2S)-1-amino-3-(1H-imidazol-5-yl)-1-oxopropan-2-yl]amino]-3-methyl-1-oxobutan-2-yl]amino]-3-hydroxy-1-oxobutan-2-yl]-2-[[(2S)-2-amino-3-phenylpropanoyl]amino]-3-methylpentanamide
SMILES (Canonical)
SMILES (Isomeric)
InChI InChI=1S/C30H46N8O6/c1-6-17(4)24(37-27(41)21(31)12-19-10-8-7-9-11-19)29(43)38-25(18(5)39)30(44)36-23(16(2)3)28(42)35-22(26(32)40)13-20-14-33-15-34-20/h7-11,14-18,21-25,39H,6,12-13,31H2,1-5H3,(H2,32,40)(H,33,34)(H,35,42)(H,36,44)(H,37,41)(H,38,43)/t17-,18+,21-,22-,23-,24-,25-/m0/s1
InChI Key FSHFRTOOSOEXRR-UPUZMWPMSA-N
Popularity 2 references in papers

Physical and Chemical Properties

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Molecular Formula C30H46N8O6
Molecular Weight 614.70 g/mol
Exact Mass 614.35403122 g/mol
Topological Polar Surface Area (TPSA) 234.00 Ų
XlogP -0.10

Synonyms

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There are no found synonyms.

2D Structure

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2D Structure of H-Phe-Ile-Thr-Val-His-NH2

3D Structure

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ADMET Properties (via admetSAR 2)

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Target Value Probability (raw) Probability (%)
No predicted properties yet!

Targets

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Proven Targets:

CHEMBL ID UniProt ID Name Min activity Assay type Source
No proven targets yet!

Predicted Targets (via Super-PRED):

CHEMBL ID UniProt ID Name Probability Model accuracy
CHEMBL2581 P07339 Cathepsin D 99.54% 98.95%
CHEMBL221 P23219 Cyclooxygenase-1 98.79% 90.17%
CHEMBL3251 P19838 Nuclear factor NF-kappa-B p105 subunit 97.51% 96.09%
CHEMBL2693 Q9UIQ6 Cystinyl aminopeptidase 94.74% 97.64%
CHEMBL1255126 O15151 Protein Mdm4 94.54% 90.20%
CHEMBL1907594 P30926 Neuronal acetylcholine receptor; alpha3/beta4 91.78% 97.23%
CHEMBL3976 Q9UHL4 Dipeptidyl peptidase II 91.70% 92.29%
CHEMBL1907600 Q00535 Cyclin-dependent kinase 5/CDK5 activator 1 90.41% 93.03%
CHEMBL4203 Q9HAZ1 Dual specificity protein kinase CLK4 89.96% 94.45%
CHEMBL1795139 Q8IU80 Transmembrane protease serine 6 89.71% 98.33%
CHEMBL2535 P11166 Glucose transporter 88.81% 98.75%
CHEMBL3108638 O15164 Transcription intermediary factor 1-alpha 88.20% 95.56%
CHEMBL1907591 P30926 Neuronal acetylcholine receptor; alpha4/beta4 88.13% 100.00%
CHEMBL3091268 Q92753 Nuclear receptor ROR-beta 88.03% 95.50%
CHEMBL255 P29275 Adenosine A2b receptor 87.81% 98.59%
CHEMBL2514 O95665 Neurotensin receptor 2 87.25% 100.00%
CHEMBL3359 P21462 Formyl peptide receptor 1 87.10% 93.56%
CHEMBL3308 P55212 Caspase-6 87.03% 97.56%
CHEMBL3060 Q9Y345 Glycine transporter 2 85.59% 99.17%
CHEMBL4657 Q6V1X1 Dipeptidyl peptidase VIII 84.81% 97.21%
CHEMBL5028 O14672 ADAM10 83.34% 97.50%
CHEMBL5939 Q9NZ08 Endoplasmic reticulum aminopeptidase 1 81.02% 100.00%
CHEMBL3776 Q14790 Caspase-8 80.65% 97.06%
CHEMBL1287628 Q9Y5S8 NADPH oxidase 1 80.00% 95.48%

Plants that contains it

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Below are displayed all the plants proven (via scientific papers) to contain this compound!
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There are no matching plants.

Cross-Links

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PubChem 102149911
LOTUS LTS0075002
wikiData Q105000631