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Home > Encyclopedia > bis[15,16-dihydroxy-17-methoxycarbonyl-9,13-dimethyl-3-(3-methylbutanoyloxy)-4,11-dioxo-5,18-dioxapentacyclo[12.5.0.01,6.02,17.08,13]nonadecan-10-yl] butanedioate

bis[15,16-dihydroxy-17-methoxycarbonyl-9,13-dimethyl-3-(3-methylbutanoyloxy)-4,11-dioxo-5,18-dioxapentacyclo[12.5.0.01,6.02,17.08,13]nonadecan-10-yl] butanedioate

bis[15,16-dihydroxy-17-methoxycarbonyl-9,13-dimethyl-3-(3-methylbutanoyloxy)-4,11-dioxo-5,18-dioxapentacyclo[12.5.0.01,6.02,17.08,13]nonadecan-10-yl] butanedioate structure

bis[15,16-dihydroxy-17-methoxycarbonyl-9,13-dimethyl-3-(3-methylbutanoyloxy)-4,11-dioxo-5,18-dioxapentacyclo[12.5.0.01,6.02,17.08,13]nonadecan-10-yl] butanedioate 

structure
  • CAS No:

    81612-56-8

  • Formula:

    C56H74O24

  • Chemical Name:

    bis[15,16-dihydroxy-17-methoxycarbonyl-9,13-dimethyl-3-(3-methylbutanoyloxy)-4,11-dioxo-5,18-dioxapentacyclo[12.5.0.01,6.02,17.08,13]nonadecan-10-yl] butanedioate

  • Synonyms:

    Bistetrahydrobrusatolyl succinate;81612-56-8;Picrasan-21-oic acid, 3,3'-((1,4-dioxo-1,4-butanediyl)bis(oxy))bis(13,20-epoxy-11,12-dihydroxy-15-(3-methyl-1-oxobutoxy)-2,16-dioxo-, dimethyl ester, (4xi,11beta,12alpha,15beta)-(4'xi,11'beta,12'alpha,15'beta)-

bis[15,16-dihydroxy-17-methoxycarbonyl-9,13-dimethyl-3-(3-methylbutanoyloxy)-4,11-dioxo-5,18-dioxapentacyclo[12.5.0.01,6.02,17.08,13]nonadecan-10-yl] butanedioate Basic Attributes

1131.2 g/mol

1130.45700322 g/mol

Characteristics

344 Ų

Computed Properties

Molecular Weight:1131.2
XLogP3:2.9
Hydrogen Bond Donor Count:4
Hydrogen Bond Acceptor Count:24
Rotatable Bond Count:19
Exact Mass:1130.45700322
Monoisotopic Mass:1130.45700322
Topological Polar Surface Area:344
Heavy Atom Count:80
Complexity:2480
Undefined Atom Stereocenter Count:24
Covalently-Bonded Unit Count:1
Compound Is Canonicalized:Yes

Guide of bis[15,16-dihydroxy-17-methoxycarbonyl-9,13-dimethyl-3-(3-methylbutanoyloxy)-4,11-dioxo-5,18-dioxapentacyclo[12.5.0.01,6.02,17.08,13]nonadecan-10-yl] butanedioate

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