(4R,5S,6S,7R)-4,7-bis(1,3-benzodioxol-5-ylmethyl)-1-benzyl-3-(cyclohexa-1,5-dien-1-ylmethyl)-5,6-dihydroxy-1,3-diazepan-2-one
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(4R,5S,6S,7R)-4,7-bis(1,3-benzodioxol-5-ylmethyl)-1-benzyl-3-(cyclohexa-1,5-dien-1-ylmethyl)-5,6-dihydroxy-1,3-diazepan-2-one
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CAS No:
177283-94-2
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Formula:
C35H36N2O7
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Chemical Name:
(4R,5S,6S,7R)-4,7-bis(1,3-benzodioxol-5-ylmethyl)-1-benzyl-3-(cyclohexa-1,5-dien-1-ylmethyl)-5,6-dihydroxy-1,3-diazepan-2-one
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Synonyms:
SC120;SC 120;177283-94-2;DTXSID60170278;(4R,5S,6S,7R)-4,7-bis(1,3-benzodioxol-5-ylmethyl)-1-benzyl-3-(cyclohexa-1,5-dien-1-ylmethyl)-5,6-dihydroxy-1,3-diazepan-2-one;(4R-(4alpha,5alpha,6beta,7beta))-Hexahydro-5,6-dihydroxy-4,7-bis(5-Benzodioxolylmethyl)-2H-1,3-diazepin-2-one;[4R-(4.alpha.,5.alpha.,6.beta.,7.beta.)]-Hexahydro-5,6-dihydroxy-4,7-bis(5-Benzodioxolylmethyl)-2H-1,3-diazepin-2-one
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CAS No:
(4R,5S,6S,7R)-4,7-bis(1,3-benzodioxol-5-ylmethyl)-1-benzyl-3-(cyclohexa-1,5-dien-1-ylmethyl)-5,6-dihydroxy-1,3-diazepan-2-one Basic Attributes
596.7 g/mol
596.25225149 g/mol
DTXSID60170278
Computed Properties
Molecular Weight:596.7
XLogP3:4.7
Hydrogen Bond Donor Count:2
Hydrogen Bond Acceptor Count:7
Rotatable Bond Count:8
Exact Mass:596.25225149
Monoisotopic Mass:596.25225149
Topological Polar Surface Area:101
Heavy Atom Count:44
Complexity:1050
Defined Atom Stereocenter Count:4
Covalently-Bonded Unit Count:1
Compound Is Canonicalized:Yes
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