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Erythrocentaurin

Erythrocentaurin structure

Erythrocentaurin 

structure
  • CAS No:

    50276-98-7

  • Formula:

    C10H8O3

  • Chemical Name:

    Erythrocentaurin

  • Synonyms:

    1H-2-Benzopyran-5-carboxaldehyde,3,4-dihydro-1-oxo-;Erythrocentaurin;Isocoumarin,5-formyl-3,4-dihydro-;3,4-Dihydro-1-oxo-1H-2-benzopyran-5-carboxaldehyde;Erythrocentaurine;1-Oxo-3,4-dihydro-1H-2-benzopyran-5-carbaldehyde;3,4-Dihydro-1-oxo-1H-2-benzopyran-5-carbaldehyde

  • Categories:

    Natural Products  >  Coumarin and Derivatives

Erythrocentaurin Basic Attributes

176.171

176.17

295RS6D94V

DTXSID30198282

Characteristics

43.4

1.3

140.5 °C

Drug Information

5-formyl-3,4-dihydroisocoumarin

Computed Properties

Molecular Weight:176.17
XLogP3:1.3
Hydrogen Bond Acceptor Count:3
Rotatable Bond Count:1
Exact Mass:176.047344113
Monoisotopic Mass:176.047344113
Topological Polar Surface Area:43.4
Heavy Atom Count:13
Complexity:224
Covalently-Bonded Unit Count:1
Compound Is Canonicalized:Yes

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