BUSERELIN
(2S)-N-[(2S)-1-[[(2S)-1-[[(2S)-1-[[(2S)-1-[[(2R)-1-[[(2S)-1-[[(2S)-5-(diaminomethylideneamino)-1-[(2S)-2-(ethylcarbamoyl)pyrrolidin-1-yl]-1-oxopentan-2-yl]amino]-4-methyl-1-oxopentan-2-yl]amino]-3-[(2-methylpropan-2-yl)oxy]-1-oxopropan-2-yl]amino]-3-(4-hydroxyphenyl)-1-oxopropan-2-yl]amino]-3-hydroxy-1-oxopropan-2-yl]amino]-3-(1H-indol-3-yl)-1-oxopropan-2-yl]amino]-3-(1H-imidazol-5-yl)-1-oxopropan-2-yl]-5-oxopyrrolidine-2-carboxamide
Molecular Identity
BUSERELIN
(2S)-N-[(2S)-1-[[(2S)-1-[[(2S)-1-[[(2S)-1-[[(2R)-1-[[(2S)-1-[[(2S)-5-(diaminomethylideneamino)-1-[(2S)-2-(ethylcarbamoyl)pyrrolidin-1-yl]-1-oxopentan-2-yl]amino]-4-methyl-1-oxopentan-2-yl]amino]-3-[(2-methylpropan-2-yl)oxy]-1-oxopropan-2-yl]amino]-3-(4-hydroxyphenyl)-1-oxopropan-2-yl]amino]-3-hydroxy-1-oxopropan-2-yl]amino]-3-(1H-indol-3-yl)-1-oxopropan-2-yl]amino]-3-(1H-imidazol-5-yl)-1-oxopropan-2-yl]-5-oxopyrrolidine-2-carboxamide
PubChem CID: 50225
Buserelin is an oligopeptide.
2D Structure
Properties
C60H86N16O13
Molecular Formula
1239.40
Molecular Weight
g/mol
1238.6560
Exact Mass
Da
-0.1
XLogP
Drug-like (Lipinski: < 5)
441
TPSA
May have limited oral absorption
15
H-Bond Donors
15
H-Bond Acceptors
2450
Complexity
SMILES
Canonical SMILES
SMILES: Synonyms(20)
BUSERELIN57982-77-1EtilamideBuserelinaBuserelineBuserelinumTilorythPXW8U3YXDVHOE 766ICI 123215DTXSID301024155NSC725176RefChem:54577L02AE01DTXCID601508411
Data from PubChem (NCBI)
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Drug Network
Trials and conditions connected to BUSERELIN
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