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Validamycin B

Validamycin B structure

Validamycin B 

structure
  • CAS No:

    102583-47-1

  • Formula:

    C20H35NO14

  • Chemical Name:

    Validamycin B

  • Synonyms:

    D-chiro-Inositol,1,5-dideoxy-4-O-β-D-glucopyranosyl-5-(hydroxymethyl)-1-[[(1S,4R,5S,6S)-4,5,6-trihydroxy-3-(hydroxymethyl)-2-cyclohexen-1-yl]amino]-;D-chiro-Inositol,1,5-dideoxy-4-O-β-D-glucopyranosyl-5-(hydroxymethyl)-1-[[4,5,6-trihydroxy-3-(hydroxymethyl)-2-cyclohexen-1-yl]amino]-,[1S-(1α,4α,5β,6α)]-;1,5-Dideoxy-4-O-β-D-glucopyranosyl-5-(hydroxymethyl)-1-[[(1S,4R,5S,6S)-4,5,6-trihydroxy-3-(hydroxymethyl)-2-cyclohexen-1-yl]amino]-D-chiro-inositol;Validamycin B;Antibiotic T 7545B;114779-27-0

Validamycin B Basic Attributes

513.49000

513.49

Characteristics

273.25000

-7.39100

1.76g/cm3

857.3ºC at 760mmHg

472.3ºC

1.708

3.13E-34mmHg at 25°C

Computed Properties

Molecular Weight:513.5
XLogP3:-6.7
Hydrogen Bond Donor Count:13
Hydrogen Bond Acceptor Count:15
Rotatable Bond Count:7
Exact Mass:513.20575479
Monoisotopic Mass:513.20575479
Topological Polar Surface Area:273
Heavy Atom Count:35
Complexity:728
Defined Atom Stereocenter Count:15
Covalently-Bonded Unit Count:1
Compound Is Canonicalized:Yes

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