Chemical Entities of Biological Interest Ontology

Last uploaded: November 5, 2024
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Preferred Name

leuprolide acetate
Synonyms

Enantone

Lupron

Pyr-His-Trp-Ser-Tyr-D-Leu-Leu-Arg-Pro-NHEt.HOAc

5-Oxo-L-prolyl-L-histidyl-L-tryptophyl-L-seryl-L-tryosyl-D-leucyl-L-leucyl-L-arginyl-N-ethyl-L-prolinamide monoacetate

Lutrate

Leuprorelin acetate

5-oxo-L-prolyl-L-histidyl-L-tryptophyl-L-seryl-L-tyrosyl-D-leucyl-L-leucyl-L-arginyl-N-ethyl-L-prolinamide--acetic acid (1/1)
Definitions

An acetate salt obtained by combining the nonapeptide leuprolide with acetic acid. A long lasting GnRH analog, LH-Rh agonist. It is a synthetic nonapeptide analogue of gonadotropin-releasing hormone, and is used as a subcutaneous hydrogel implant for the treatment of prostate cancer and for the suppression of gonadal sex hormone production in children with central precocious puberty.
ID

http://purl.obolibrary.org/obo/CHEBI_63597
charge

0
database_cross_reference

PMID:22025196

PMID:21847353

DrugBank:DB00007

Wikipedia:Leuprorelin

PMID:21790701

PMID:21239017

CAS:74381-53-6

PMID:21564386

PMID:22136615

Reaxys:5570787

PMID:21864378

PMID:22133574

PMID:21276459

PMID:22050405

PMID:21860633

PMID:21801354

KEGG:D00989

PMID:21324455
definition

An acetate salt obtained by combining the nonapeptide leuprolide with acetic acid. A long lasting GnRH analog, LH-Rh agonist. It is a synthetic nonapeptide analogue of gonadotropin-releasing hormone, and is used as a subcutaneous hydrogel implant for the treatment of prostate cancer and for the suppression of gonadal sex hormone production in children with central precocious puberty.
formula

C61H88N16O14
has part

http://purl.obolibrary.org/obo/CHEBI_6427
has role

http://purl.obolibrary.org/obo/CHEBI_35610

http://purl.obolibrary.org/obo/CHEBI_63533
has_alternative_id

CHEBI:6428
has_exact_synonym

5-oxo-L-prolyl-L-histidyl-L-tryptophyl-L-seryl-L-tyrosyl-D-leucyl-L-leucyl-L-arginyl-N-ethyl-L-prolinamide--acetic acid (1/1)
has_obo_namespace

chebi_ontology
has_related_synonym

Enantone

Lupron

Pyr-His-Trp-Ser-Tyr-D-Leu-Leu-Arg-Pro-NHEt.HOAc

5-Oxo-L-prolyl-L-histidyl-L-tryptophyl-L-seryl-L-tryosyl-D-leucyl-L-leucyl-L-arginyl-N-ethyl-L-prolinamide monoacetate

Lutrate

Leuprorelin acetate
id

CHEBI:63597
in_subset

http://purl.obolibrary.org/obo/chebi#3_STAR
inchi

InChI=1S/C59H84N16O12.C2H4O2/c1-6-63-57(86)48-14-10-22-75(48)58(87)41(13-9-21-64-59(60)61)68-51(80)42(23-32(2)3)69-52(81)43(24-33(4)5)70-53(82)44(25-34-15-17-37(77)18-16-34)71-56(85)47(30-76)74-54(83)45(26-35-28-65-39-12-8-7-11-38(35)39)72-55(84)46(27-36-29-62-31-66-36)73-50(79)40-19-20-49(78)67-40;1-2(3)4/h7-8,11-12,15-18,28-29,31-33,40-48,65,76-77H,6,9-10,13-14,19-27,30H2,1-5H3,(H,62,66)(H,63,86)(H,67,78)(H,68,80)(H,69,81)(H,70,82)(H,71,85)(H,72,84)(H,73,79)(H,74,83)(H4,60,61,64);1H3,(H,3,4)/t40-,41-,42-,43+,44-,45-,46-,47-,48-;/m0./s1
inchikey

RGLRXNKKBLIBQS-XNHQSDQCSA-N
label

leuprolide acetate
mass

1269.45020
monoisotopicmass

1268.66659
notation

CHEBI:63597
prefLabel

leuprolide acetate
smiles

CC(O)=O.CCNC(=O)[C@@H]1CCCN1C(=O)[C@H](CCCNC(N)=N)NC(=O)[C@H](CC(C)C)NC(=O)[C@@H](CC(C)C)NC(=O)[C@H](Cc1ccc(O)cc1)NC(=O)[C@H](CO)NC(=O)[C@H](Cc1c[nH]c2ccccc12)NC(=O)[C@H](Cc1c[nH]cn1)NC(=O)[C@@H]1CCC(=O)N1
treeView

http://purl.obolibrary.org/obo/CHEBI_59230
subClassOf

http://purl.obolibrary.org/obo/CHEBI_59230
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