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delaminomycin A

delaminomycin A structure

delaminomycin A 

structure
  • CAS No:

    149779-38-4

  • Formula:

    C29H43NO6

  • Chemical Name:

    delaminomycin A

  • Synonyms:

    3-((2-(2,8-dihydroxy-7-methyl-3,5-decadienyl)-1,6,8-trimethyl-1,2,4a,5,6,7,8,8a-octahydro-1-naphthyl)carbonyl)-5-hydroxypyrrolidine-2,4-dione;delaminomycin A;2H-Imidazol-2-one, 3-((2-(2,8-dihydroxy-7-methyl-3,5-decadienyl)-1,2,4a,5,6,7,8,8a-octahydro-1,6,8-trimethyl-1-naphthalenyl)carbonyl)-1,5-dihydro-4,5-dihydroxy-5-methoxy-;2H-Pyrrol-2-one, 1,5-dihydro-4,5-dihydroxy-3-((2-(2,8-dihydroxy-7-methyl-3,5-decadienyl)-1,2,4a,5,6,7,8,8a-octahydrox-1,6,8-trimethyl-1-naphthalenyl)carbonyl)-;LS-139433;(3Z)-3-[[2-[(3E,5E)-2,8-dihydroxy-7-methyldeca-3,5-dienyl]-1,6,8-trimethyl-4a,5,6,7,8,8a-hexahydro-2H-naphthalen-1-yl]-hydroxymethylidene]-5-hydroxypyrrolidine-2,4-dione

delaminomycin A Basic Attributes

501.66

501.309038

Characteristics

127

1.162±0.06 g/cm3(Predicted)

739.4±60.0 °C(Predicted)

Drug Information

3-((2-(2,8-dihydroxy-7-methyl-3,5-decadienyl)-1,6,8-trimethyl-1,2,4a,5,6,7,8,8a-octahydro-1-naphthyl)carbonyl)-5-hydroxypyrrolidine-2,4-dione

Computed Properties

Molecular Weight:501.7
XLogP3:5
Hydrogen Bond Donor Count:5
Hydrogen Bond Acceptor Count:6
Rotatable Bond Count:8
Exact Mass:501.30903809
Monoisotopic Mass:501.30903809
Topological Polar Surface Area:127
Heavy Atom Count:36
Complexity:951
Undefined Atom Stereocenter Count:10
Defined Bond Stereocenter Count:3
Covalently-Bonded Unit Count:1
Compound Is Canonicalized:Yes

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