138661-18-4
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138661-18-4
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CAS No:
138661-18-4
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Formula:
C53H86ClN9O18
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Chemical Name:
138661-18-4
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Synonyms:
L-688,786 prodrug-8g; cyclic (6(R)1)-peptide,4-ester with b-alanine,monohydrochloride,trans; L-Proline,N-(10,12-dimethyl-1-oxotetradecyl)-(4R,5R)-4,5-dihydroxy-L-ornithyl-L-threonyl-trans-4-hydroxy-L-prolyl-(S)-4-hydroxy-4-(4-hydroxyphenyl)-L-threonyl-threo-3-hydroxy-L-glutaminyl-3-hydroxy-,cyclic (6y1)-peptide,4-ester with b-alanine,monohydrochloride,trans;
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CAS No:
Computed Properties
Molecular Weight:1172.8
Hydrogen Bond Donor Count:16
Hydrogen Bond Acceptor Count:19
Rotatable Bond Count:24
Exact Mass:1171.5779346
Monoisotopic Mass:1171.5779346
Topological Polar Surface Area:443
Heavy Atom Count:81
Complexity:2090
Undefined Atom Stereocenter Count:16
Covalently-Bonded Unit Count:2
Compound Is Canonicalized:Yes
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