PLECANATIDE
(2S)-2-[[(1R,4S,7S,10S,13S,16R,19S,22S,25R,32S,38R)-10-(2-amino-2-oxoethyl)-25-[[(2S)-4-carboxy-2-[[(2S)-3-carboxy-2-[[(2S)-2,4-diamino-4-oxobutanoyl]amino]propanoyl]amino]butanoyl]amino]-22-(2-carboxyethyl)-32-[(1R)-1-hydroxyethyl]-4-methyl-19-(2-methylpropyl)-3,6,9,12,15,18,21,24,30,33,36-undecaoxo-7,13-di(propan-2-yl)-27,28,40,41-tetrathia-2,5,8,11,14,17,20,23,31,34,37-undecazabicyclo[14.13.13]dotetracontane-38-carbonyl]amino]-4-methylpentanoic acid
Molecular Identity
PLECANATIDE
(2S)-2-[[(1R,4S,7S,10S,13S,16R,19S,22S,25R,32S,38R)-10-(2-amino-2-oxoethyl)-25-[[(2S)-4-carboxy-2-[[(2S)-3-carboxy-2-[[(2S)-2,4-diamino-4-oxobutanoyl]amino]propanoyl]amino]butanoyl]amino]-22-(2-carboxyethyl)-32-[(1R)-1-hydroxyethyl]-4-methyl-19-(2-methylpropyl)-3,6,9,12,15,18,21,24,30,33,36-undecaoxo-7,13-di(propan-2-yl)-27,28,40,41-tetrathia-2,5,8,11,14,17,20,23,31,34,37-undecazabicyclo[14.13.13]dotetracontane-38-carbonyl]amino]-4-methylpentanoic acid
PubChem CID: 70693500
2D Structure
Properties
C65H104N18O26S4
Molecular Formula
1681.90
Molecular Weight
g/mol
1680.6252
Exact Mass
Da
-8.2
XLogP
Drug-like (Lipinski: < 5)
819
TPSA
May have limited oral absorption
23
H-Bond Donors
31
H-Bond Acceptors
3490
Complexity
SMILES
Canonical SMILES
SMILES: Synonyms(20)
PLECANATIDETrulance467426-54-6Guanilibplecanatida7IK8Z952OKSP-304 (SYNERGY)DTXSID60196933(3-Glutamic acid(D>E))human uroguanylin[3-glutamic acid(D>E)]human uroguanylinplecanatidumRefChem:56535Trulance Immediate releaseA06AX07DTXCID00119424
Data from PubChem (NCBI)
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