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Ergocalciferol

Ergocalciferol

API0232347

Ergocalciferol

Erdafitinib is an anticancer drug (FGFR inhibitor).

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API Description
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Related Patent Status
  • CAS No.

    50-14-6

  • Synonyms

    ergocalciferol; VITAMIN D2; Calciferol

  • CHEMBL ID

    CHEMBL1536

  • Molecule Type

    Small molecule

  • Compound CID

    5280793

  • Molecular Weight (g/mol)

    396.6

  • Molecular Formula

    C28H44O

  • InChI

    InChI=1S/C28H44O/c1-19(2)20(3)9-10-22(5)26-15-16-27-23(8-7-17-28(26,27)6)12-13-24-18-25(29)14-11-21(24)4/h9-10,12-13,19-20,22,25-27,29H,4,7-8,11,14-18H2,1-3,5-6H3/b10-9+,23-12+,24-13-/t20-,22+,25-,26+,27-,28+/m0/s1

  • InChIKey

    MECHNRXZTMCUDQ-RKHKHRCZSA-N

  • SMILES

    C[C@H](/C=C/[C@H](C)C(C)C)[C@H]1CC[C@@H]\2[C@@]1(CCC/C2=C\C=C/3\C[C@H](CCC3=C)O)C

  • IUPAC Name

    (1S,3Z)-3-[(2E)-2-[(1R,3aS,7aR)-1-[(E,2R,5R)-5,6-dimethylhept-3-en-2-yl]-7a-methyl-2,3,3a,5,6,7-hexahydro-1H-inden-4-ylidene]ethylidene]-4-methylidenecyclohexan-1-ol

  • Exact Mass (Da)

    396.339216023

  • Monoisotopic Mass (Da)

    396.339216023

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