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TUMULOSICACID

TUMULOSICACID structure

TUMULOSICACID 

structure
  • CAS No:

    508-24-7

  • Formula:

    C31H50O4

  • Chemical Name:

    TUMULOSICACID

  • Synonyms:

    Tumulosic acid;CHEMBL461484;SCHEMBL12952336;(2R)-2-[(3S,5R,10S,13R,14R,16R,17R)-3,16-dihydroxy-4,4,10,13,14-pentamethyl-2,3,5,6,7,11,12,15,16,17-decahydro-1H-cyclopenta[a]phenanthren-17-yl]-6-methyl-5-methylideneheptanoic acid

TUMULOSICACID Basic Attributes

486.72600

486.37100

Characteristics

77.76000

6.76060

1.10±0.1 g/cm3(Predicted)

306 °C (decomp)

Computed Properties

Molecular Weight:486.7
XLogP3:6.7
Hydrogen Bond Donor Count:3
Hydrogen Bond Acceptor Count:4
Rotatable Bond Count:6
Exact Mass:486.37091007
Monoisotopic Mass:486.37091007
Topological Polar Surface Area:77.8
Heavy Atom Count:35
Complexity:915
Defined Atom Stereocenter Count:8
Covalently-Bonded Unit Count:1
Compound Is Canonicalized:Yes

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