Cas no 73246-54-5 ( )

  structure
  structure
Product Name: 
CAS No:73246-54-5
MF:C30H40O5
MW:480.63560962677
CID:977925
PubChem ID:320914
Update Time:2025-04-19

  Chemical and Physical Properties

Names and Identifiers

    • methyl 3,10-dihydroxy-2,4a,6a,6a,9,14a-hexamethyl-11-oxo-1,3,4,5,6,13,14,14b-octahydropicene-2-carboxylate
    • AC1L8381
    • Hydroxypristimerin
    • HYDROXY-PRISTIMERIN
    • NCI60_002205
    • NSC270057
    • NSC-270057
    • 73246-54-5
    • DTXSID40313429
    • CHEMBL1985284
    •  
    • Inchi: 1S/C30H40O5/c1-17-18-8-9-21-27(3,19(18)14-20(31)24(17)33)11-13-30(6)22-15-28(4,25(34)35-7)23(32)16-26(22,2)10-12-29(21,30)5/h8-9,14,22-23,32-33H,10-13,15-16H2,1-7H3
    • InChI Key: HDIIUCVOZICRAQ-UHFFFAOYSA-N
    • SMILES: OC1C(C(=O)OC)(C)CC2C(C)(C1)CCC1(C)C3=CC=C4C(C)=C(C(C=C4C3(C)CCC21C)=O)O

Computed Properties

  • Exact Mass: 480.28757437g/mol
  • Monoisotopic Mass: 480.28757437g/mol
  • Isotope Atom Count: 0
  • Hydrogen Bond Donor Count: 2
  • Hydrogen Bond Acceptor Count: 5
  • Heavy Atom Count: 35
  • Rotatable Bond Count: 2
  • Complexity: 1160
  • Covalently-Bonded Unit Count: 1
  • Defined Atom Stereocenter Count: 0
  • Undefined Atom Stereocenter Count : 7
  • Defined Bond Stereocenter Count: 0
  • Undefined Bond Stereocenter Count: 0
  • XLogP3: 5.7
  • Topological Polar Surface Area: 83.8?2
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