(6S,12S,18S,21S)-15-[(2S)-butan-2-yl]-6-[(4-hydroxyphenyl)methyl]-12,18-bis(2-methylpropyl)-1,4,7,10,13,16,19-heptazabicyclo[19.3.0]tetracosane-2,5,8,11,14,17,20-heptone
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(6S,12S,18S,21S)-15-[(2S)-butan-2-yl]-6-[(4-hydroxyphenyl)methyl]-12,18-bis(2-methylpropyl)-1,4,7,10,13,16,19-heptazabicyclo[19.3.0]tetracosane-2,5,8,11,14,17,20-heptone
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CAS No:
158335-65-0
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Formula:
C36H55N7O8
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Chemical Name:
(6S,12S,18S,21S)-15-[(2S)-butan-2-yl]-6-[(4-hydroxyphenyl)methyl]-12,18-bis(2-methylpropyl)-1,4,7,10,13,16,19-heptazabicyclo[19.3.0]tetracosane-2,5,8,11,14,17,20-heptone
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Synonyms:
cyclo(Gly-Pro-Leu-Ile-Leu-Gly-Tyr);pseudostellarin D;Pseudostellarin D;158335-65-0;Cyclo(gly-pro-leu-ile-leu-gly-tyr);4-Bromobenzylmercaptane;DTXSID20935906;(6S,12S,18S,21S)-15-[(2S)-butan-2-yl]-6-[(4-hydroxyphenyl)methyl]-12,18-bis(2-methylpropyl)-1,4,7,10,13,16,19-heptazabicyclo[19.3.0]tetracosane-2,5,8,11,14,17,20-heptone;A4289;6-(Butan-2-yl)-1,4,7,10,13,16-hexahydroxy-15-[(4-hydroxyphenyl)methyl]-3,9-bis(2-methylpropyl)-3,6,9,12,15,18,21,22,23,23a-decahydro-19H-pyrrolo[1,2-a][1,4,7,10,13,16,19]heptaazacyclohenicosin-19-one
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CAS No:
(6S,12S,18S,21S)-15-[(2S)-butan-2-yl]-6-[(4-hydroxyphenyl)methyl]-12,18-bis(2-methylpropyl)-1,4,7,10,13,16,19-heptazabicyclo[19.3.0]tetracosane-2,5,8,11,14,17,20-heptone Basic Attributes
713.9 g/mol
713.41121174 g/mol
Computed Properties
Molecular Weight:713.9
XLogP3:2.9
Hydrogen Bond Donor Count:7
Hydrogen Bond Acceptor Count:8
Rotatable Bond Count:8
Exact Mass:713.41121174
Monoisotopic Mass:713.41121174
Topological Polar Surface Area:215
Heavy Atom Count:51
Complexity:1250
Defined Atom Stereocenter Count:5
Undefined Atom Stereocenter Count:1
Covalently-Bonded Unit Count:1
Compound Is Canonicalized:Yes
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