(2S,3S)-N-[(2S,3R,4R,5S)-3,4-dihydroxy-5-[[(2S,3S)-3-methyl-2-[(2-pyridin-2-ylacetyl)amino]pentanoyl]amino]-1,6-diphenylhexan-2-yl]-3-methyl-2-[(2-pyridin-2-ylacetyl)amino]pentanamide
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![(2S,3S)-N-[(2S,3R,4R,5S)-3,4-dihydroxy-5-[[(2S,3S)-3-methyl-2-[(2-pyridin-2-ylacetyl)amino]pentanoyl]amino]-1,6-diphenylhexan-2-yl]-3-methyl-2-[(2-pyridin-2-ylacetyl)amino]pentanamide structure](https://file.echemi.com/fileManage/upload/canonicalSmiles/20220811/f71cb89acd664c03bd9ea9b7f5b621ed.png "(2S,3S)-N-[(2S,3R,4R,5S)-3,4-dihydroxy-5-[[(2S,3S)-3-methyl-2-[(2-pyridin-2-ylacetyl)amino]pentanoyl]amino]-1,6-diphenylhexan-2-yl]-3-methyl-2-[(2-pyridin-2-ylacetyl)amino]pentanamide")
(2S,3S)-N-[(2S,3R,4R,5S)-3,4-dihydroxy-5-[[(2S,3S)-3-methyl-2-[(2-pyridin-2-ylacetyl)amino]pentanoyl]amino]-1,6-diphenylhexan-2-yl]-3-methyl-2-[(2-pyridin-2-ylacetyl)amino]pentanamide
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CAS No:
140196-60-7
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Formula:
C44H56N6O6
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Chemical Name:
(2S,3S)-N-[(2S,3R,4R,5S)-3,4-dihydroxy-5-[[(2S,3S)-3-methyl-2-[(2-pyridin-2-ylacetyl)amino]pentanoyl]amino]-1,6-diphenylhexan-2-yl]-3-methyl-2-[(2-pyridin-2-ylacetyl)amino]pentanamide
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Synonyms:
P 9941;P-9941;P9941;P9941;140196-60-7;(2S,3R,4R,5S)-N,N'-Bis((2-pyridylacetyl)-L-isoleucinyl)-2,5-diamino-1,6-diphenylhexane-3,4-diol;(2S,3R,4R,5S)-N,N'-Bis([2-pyridylacetyl]-L-isoleucinyl)-2,5-diamino-1,6-diphenylhexane-3,4-diol;P 9941;Bis(2-PyAc-Ile-Phe-psi-(CHOH));Bis(2-PyAc-Ile-Phe-.psi.-[CHOH]);(2S,3S)-N-[(2S,3R,4R,5S)-3,4-dihydroxy-5-[[(2S,3S)-3-methyl-2-[(2-pyridin-2-ylacetyl)amino]pentanoyl]amino]-1,6-diphenylhexan-2-yl]-3-methyl-2-[(2-pyridin-2-ylacetyl)amino]pentanamide;(2s,3s)-n-[(1s,2r,3r,4s)-1-benzyl-2,3-dihydroxy-4-[[(2s,3s)-3-methyl-2-[[2-(2-pyridyl)acetyl]amino]pentanoyl]amino]-5-phenyl-pentyl]-3-methyl-2-[[2-(2-pyridyl)acetyl]amino]pentanamide
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CAS No:
(2S,3S)-N-[(2S,3R,4R,5S)-3,4-dihydroxy-5-[[(2S,3S)-3-methyl-2-[(2-pyridin-2-ylacetyl)amino]pentanoyl]amino]-1,6-diphenylhexan-2-yl]-3-methyl-2-[(2-pyridin-2-ylacetyl)amino]pentanamide Basic Attributes
765.0 g/mol
764.42613353 g/mol
Computed Properties
Molecular Weight:765.0
XLogP3:4.9
Hydrogen Bond Donor Count:6
Hydrogen Bond Acceptor Count:8
Rotatable Bond Count:21
Exact Mass:764.42613353
Monoisotopic Mass:764.42613353
Topological Polar Surface Area:183
Heavy Atom Count:56
Complexity:1100
Defined Atom Stereocenter Count:8
Covalently-Bonded Unit Count:1
Compound Is Canonicalized:Yes
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