CHEBI ONTOLOGY - ANNOTATIONS
The Chemical Entities of Biological Interest (ChEBI) ontology is downloaded weekly from EMBL-EBI at http://www.ebi.ac.uk/chebi/ . The data is made available under the Creative Commons License (CC BY 3.0, http://creativecommons.org/licenses/by/3.0/ ). For more information see: Degtyarenko et al. (2008) ChEBI: a database and ontology for chemical entities of biological interest. Nucleic Acids Res. 36, D344–D350.
Term: plitidepsin
Accession: CHEBI:90205
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Definition: A didemnin that is didemin B in which the hydroxy group of the 1-(2-hydroxypropanoyl)-L-prolinamide moiety has been oxidised to the corresponding ketone. It was originally isolated from the Mediterranean tunicate Aplidium albicans.
Synonyms: exact_synonym: 1-(2-oxopropanoyl)-L-prolyl-N-[(3S,6R,7S,10R,11S,15S,17S,20S,25aS)-10-[(2S)-butan-2-yl]-11-hydroxy-3-(4-methoxybenzyl)-2,6,17-trimethyl-20-(2-methylpropyl)-1,4,8,13,16,18,21-heptaoxo-15-(propan-2-yl)docosahydro-15H-pyrrolo[2,1-f][1,15,4,7,10,20]dioxatetraazacyclotricosin-7-yl]-N(2)-methyl-D-leucinamide
related_synonym: Aplidin; Aplidine; Formula=C57H87N7O15; InChI=1S/C57H87N7O15/c1-15-33(8)46-44(66)29-45(67)79-49(32(6)7)48(68)34(9)50(69)58-39(26-30(2)3)54(73)64-25-17-19-41(64)56(75)62(13)43(28-37-20-22-38(77-14)23-21-37)57(76)78-36(11)47(52(71)59-46)60-51(70)42(27-31(4)5)61(12)55(74)40-18-16-24-63(40)53(72)35(10)65/h20-23,30-34,36,39-44,46-47,49,66H,15-19,24-29H2,1-14H3,(H,58,69)(H,59,71)(H,60,70)/t33-,34-,36+,39-,40-,41-,42+,43-,44-,46+,47-,49-/m0/s1; InChIKey=UUSZLLQJYRSZIS-LXNNNBEUSA-N; SMILES=N1(C(=O)[C@]2(N(C([C@](NC([C@H](C([C@@](OC(C[C@@H]([C@H](NC([C@H]([C@H](OC([C@@]1(CC=3C=CC(=CC3)OC)[H])=O)C)NC([C@](N(C)C(=O)[C@]4(N(CCC4)C(=O)C(C)=O)[H])(CC(C)C)[H])=O)=O)[C@](CC)(C)[H])O)=O)(C(C)C)[H])=O)C)=O)([H])CC(C)C)=O)CCC2)[H])C; dehydrodidemnin B; plitidepsina; plitidepsine; plitidepsium
xref: CAS:137219-37-5; DrugBank:DB04977; KEGG:C16862; KNApSAcK:C00044529
xref_mesh: MESH:C098980
xref: PMID:16278386; PMID:18941750; PMID:19513942; PMID:19687728; PMID:21747745; PMID:22336911; PMID:23697951; PMID:24287622; PMID:24473171; PMID:25681727; PMID:25768401; PMID:33495306; Patent:WO1991004985; Wikipedia:Plitidepsin
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Akt1
AKT serine/threonine kinase 1
multiple interactions
ISO
AKT1 protein affects the reaction [plitidepsin results in increased activity of MAPK8 protein]; plitidepsin results in increased phosphorylation of and results in increased activity of AKT1 protein
CTD
PMID:18089842
NCBI chr 6:131,713,716...131,735,319
Ensembl chr 6:131,713,720...131,733,921
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Eef1a1
eukaryotic translation elongation factor 1 alpha 1
increases response to substance
ISO
EEF1A1 protein results in increased susceptibility to plitidepsin
CTD
PMID:33495306
NCBI chr 8:79,341,554...79,344,784
Ensembl chr 8:79,341,557...79,344,839
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Mapk8
mitogen-activated protein kinase 8
multiple interactions increases activity
ISO
AKT1 protein affects the reaction [plitidepsin results in increased activity of MAPK8 protein]
CTD
PMID:18089842
NCBI chr16:8,638,897...8,721,960
Ensembl chr16:8,638,924...8,721,981
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Rac1
Rac family small GTPase 1
increases activity
ISO
plitidepsin results in increased activity of RAC1 protein
CTD
PMID:18089842
NCBI chr12:11,037,028...11,057,251
Ensembl chr12:11,036,698...11,057,251
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