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Home > Encyclopedia > methyl 3-[(3aR,5aR,6S,7S,9aR,9bR)-9a,9b-dimethyl-7-prop-1-en-2-yl-3a,4,5,5a,6,7,8,9-octahydro-1H-cyclopenta[a]naphthalen-6-yl]propanoate

methyl 3-[(3aR,5aR,6S,7S,9aR,9bR)-9a,9b-dimethyl-7-prop-1-en-2-yl-3a,4,5,5a,6,7,8,9-octahydro-1H-cyclopenta[a]naphthalen-6-yl]propanoate

methyl 3-[(3aR,5aR,6S,7S,9aR,9bR)-9a,9b-dimethyl-7-prop-1-en-2-yl-3a,4,5,5a,6,7,8,9-octahydro-1H-cyclopenta[a]naphthalen-6-yl]propanoate structure

methyl 3-[(3aR,5aR,6S,7S,9aR,9bR)-9a,9b-dimethyl-7-prop-1-en-2-yl-3a,4,5,5a,6,7,8,9-octahydro-1H-cyclopenta[a]naphthalen-6-yl]propanoate 

structure
  • CAS No:

    102848-63-5

  • Formula:

    C22H34O2

  • Chemical Name:

    methyl 3-[(3aR,5aR,6S,7S,9aR,9bR)-9a,9b-dimethyl-7-prop-1-en-2-yl-3a,4,5,5a,6,7,8,9-octahydro-1H-cyclopenta[a]naphthalen-6-yl]propanoate

  • Synonyms:

    mansumbinoic acid;102848-63-5;DTXSID70908089;1H-Benz(e)indene-6-propanoic acid, 3a,4,5,5a,6,7,8,9,9a,9b-decahydro-6,9a,9b-trimethyl-7-(1-methylethenyl)-, (3aR-(3aalpha,5abeta,6beta,7alpha,9aalpha,9bbeta))-;Methyl 3-[9a,9b-dimethyl-7-(prop-1-en-2-yl)-3a,4,5,5a,6,7,8,9,9a,9b-decahydro-1H-cyclopenta[a]naphthalen-6-yl]propanoate

methyl 3-[(3aR,5aR,6S,7S,9aR,9bR)-9a,9b-dimethyl-7-prop-1-en-2-yl-3a,4,5,5a,6,7,8,9-octahydro-1H-cyclopenta[a]naphthalen-6-yl]propanoate Basic Attributes

330.5 g/mol

330.255880323 g/mol

Characteristics

26.3 Ų

Drug Information

mansumbinoic acid

Computed Properties

Molecular Weight:330.5
XLogP3:6.4
Hydrogen Bond Acceptor Count:2
Rotatable Bond Count:5
Exact Mass:330.255880323
Monoisotopic Mass:330.255880323
Topological Polar Surface Area:26.3
Heavy Atom Count:24
Complexity:548
Defined Atom Stereocenter Count:6
Covalently-Bonded Unit Count:1
Compound Is Canonicalized:Yes

Guide of methyl 3-[(3aR,5aR,6S,7S,9aR,9bR)-9a,9b-dimethyl-7-prop-1-en-2-yl-3a,4,5,5a,6,7,8,9-octahydro-1H-cyclopenta[a]naphthalen-6-yl]propanoate

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