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Home > Encyclopedia > methyl 2-[(2S,4R,5R,14R)-2,5-diacetyloxy-7,12-dimethyl-17-oxo-11,16,18,19-tetraoxapentacyclo[12.2.2.16,9.01,15.010,12]nonadeca-6,8-dien-4-yl]prop-2-enoate

methyl 2-[(2S,4R,5R,14R)-2,5-diacetyloxy-7,12-dimethyl-17-oxo-11,16,18,19-tetraoxapentacyclo[12.2.2.16,9.01,15.010,12]nonadeca-6,8-dien-4-yl]prop-2-enoate

methyl 2-[(2S,4R,5R,14R)-2,5-diacetyloxy-7,12-dimethyl-17-oxo-11,16,18,19-tetraoxapentacyclo[12.2.2.16,9.01,15.010,12]nonadeca-6,8-dien-4-yl]prop-2-enoate structure

methyl 2-[(2S,4R,5R,14R)-2,5-diacetyloxy-7,12-dimethyl-17-oxo-11,16,18,19-tetraoxapentacyclo[12.2.2.16,9.01,15.010,12]nonadeca-6,8-dien-4-yl]prop-2-enoate 

structure
  • CAS No:

    99552-28-0

  • Formula:

    C25H28O11

  • Chemical Name:

    methyl 2-[(2S,4R,5R,14R)-2,5-diacetyloxy-7,12-dimethyl-17-oxo-11,16,18,19-tetraoxapentacyclo[12.2.2.16,9.01,15.010,12]nonadeca-6,8-dien-4-yl]prop-2-enoate

  • Synonyms:

    bipinnatin A;bipinnatin-A;Bipinnatin-A;Bipinnatin A;99552-28-0;DTXSID90912628;11,16,18,19-Tetraoxapentacyclo(12.2.2.16,9.01,15.010,12)nonadeca-6,8-diene-4-acetic acid, 2,5-bis(acetyloxy)-7,12-dimethyl-alpha-methylene-17-oxo-, methyl ester, (1S-(1R*,2R*,4S*,5S*,10R*,12R*,14S*,15S*))-;Methyl 2-[2,5-bis(acetyloxy)-7,12-dimethyl-17-oxo-11,16,18,19-tetraoxapentacyclo[12.2.2.1~6,9~.0~1,15~.0~10,12~]nonadeca-6,8-dien-4-yl]prop-2-enoate

methyl 2-[(2S,4R,5R,14R)-2,5-diacetyloxy-7,12-dimethyl-17-oxo-11,16,18,19-tetraoxapentacyclo[12.2.2.16,9.01,15.010,12]nonadeca-6,8-dien-4-yl]prop-2-enoate Basic Attributes

504.5 g/mol

504.16316171 g/mol

Characteristics

143 Ų

Drug Information

bipinnatin A

Computed Properties

Molecular Weight:504.5
XLogP3:1.2
Hydrogen Bond Acceptor Count:11
Rotatable Bond Count:7
Exact Mass:504.16316171
Monoisotopic Mass:504.16316171
Topological Polar Surface Area:143
Heavy Atom Count:36
Complexity:1010
Defined Atom Stereocenter Count:4
Undefined Atom Stereocenter Count:4
Covalently-Bonded Unit Count:1
Compound Is Canonicalized:Yes

Guide of methyl 2-[(2S,4R,5R,14R)-2,5-diacetyloxy-7,12-dimethyl-17-oxo-11,16,18,19-tetraoxapentacyclo[12.2.2.16,9.01,15.010,12]nonadeca-6,8-dien-4-yl]prop-2-enoate

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