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Sporidesmin D

Sporidesmin D structure

Sporidesmin D 

structure
  • CAS No:

    18180-71-7

  • Formula:

    C20H26ClN3O6S2

  • Chemical Name:

    Sporidesmin D

  • Synonyms:

    S,S'-Dimethylsecosporidesmin; 2H-Pyrazino(1',2':1,5)pyrrolo(2,3-b)indole-1,4(3H,5aH)-dione,9-chloro-6,10b,11,11a-tetrahydro-10b,11-dihydroxy-7,8-dimethoxy-2,3,6-trimethyl-3,11a-bis(methylthio); 9-chloro-10b,11-dihydroxy-7,8-dimethoxy-2,3,6-trimethyl-3,11a-bis-methylsulfanyl-2,3,6,10b,11,11a-hexahydro-5aH-pyrazino[1',2':1,5]pyrrolo[2,3-b]indole-1,4-dione; sporidesmin-D;

Sporidesmin D Basic Attributes

504.02000

503.0951556

Characteristics

153.38000

1.07510

1.56g/cm3

756ºC

407.8ºC

1.701

1.14E-23mmHg at 25°C

Safety Information

III

6.1(b)

UN 1544

Computed Properties

Molecular Weight:504.0
XLogP3:1.1
Hydrogen Bond Donor Count:2
Hydrogen Bond Acceptor Count:9
Rotatable Bond Count:4
Exact Mass:503.0951556
Monoisotopic Mass:503.0951556
Topological Polar Surface Area:153
Heavy Atom Count:32
Complexity:826
Undefined Atom Stereocenter Count:5
Covalently-Bonded Unit Count:1
Compound Is Canonicalized:Yes

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