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Home > Encyclopedia > (8aS)-8a-BroMoalboMitoMycinA

(8aS)-8a-BroMoalboMitoMycinA

(8aS)-8a-BroMoalboMitoMycinA structure

(8aS)-8a-BroMoalboMitoMycinA 

structure
  • CAS No:

    132830-44-5

  • Formula:

    C16H18BrN3O6

  • Chemical Name:

    (8aS)-8a-BroMoalboMitoMycinA

  • Synonyms:

    (8aS)-8a-BroMoalboMitoMycin A;1,2,5-Metheno-1H,5H-imidazo[2,1-i]indole-7,10-dione, 6-[[(aminocarbonyl)oxy]methyl]-6a-bromo-2,3,6,6a-tetrahydro-5,8-dimethoxy-9-methyl-, [1S-(1α,2α,4β,5β,6α,6aα,10aS*,11R*)]- (9CI)

(8aS)-8a-BroMoalboMitoMycinA Basic Attributes

428.23

428.04572

Characteristics

1.83±0.1 g/cm3

597.5±50.0 °C(Predicted)

13.31±0.50

(8aS)-8a-BroMoalboMitoMycinA Use and Manufacturing

An intermediate formed during the chemical conversion of Mitomycin A (M371890) to isomitomycin A

Computed Properties

Molecular Weight:429.24
XLogP3:-0.3
Hydrogen Bond Donor Count:2
Hydrogen Bond Acceptor Count:7
Rotatable Bond Count:5
Exact Mass:428.04572
Monoisotopic Mass:428.04572
Topological Polar Surface Area:112
Heavy Atom Count:26
Formal Charge:1
Complexity:831
Defined Atom Stereocenter Count:6
Covalently-Bonded Unit Count:1
Compound Is Canonicalized:Yes

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