Taraxerone

CAS Registry Number®

514-07-8
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CAS Name

Taraxerone

Molecular Formula

C30H48O

Molecular Mass

424.70

Cite this Page

Taraxerone.   CAS Common Chemistry.   CAS, a division of the American Chemical Society, n.d.   http://commonchemistry.cas.org/ChemicalDetail.aspx?ref=514-07-8 (retrieved 2024-05-06) (CAS RN: 514-07-8).  Licensed under the Attribution-Noncommercial 4.0 International License (CC BY-NC 4.0).

Compound Properties

  • Melting Point (1)

    241-243 °C

Source(s)

Other Names and Identifiers

InChI

InChI=1S/C30H48O/c1-25(2)17-18-27(5)13-9-21-29(7)14-10-20-26(3,4)24(31)12-16-28(20,6)22(29)11-15-30(21,8)23(27)19-25/h9,20,22-23H,10-19H2,1-8H3/t20-,22+,23+,27-,28-,29-,30+/m0/s1

InChIKey

InChIKey=DBCAVZSSFGIHQZ-YLAYQGCQSA-N

SMILES

C[C@]12C=3[C@](C)([C@]4([C@@](C)(CC3)CCC(C)(C)C4)[H])CC[C@@]1([C@]5(C)[C@@](CC2)(C(C)(C)C(=O)CC5)[H])[H]

Canonical SMILES

O=C1CCC2(C)C(CCC3(C4=CCC5(C)CCC(C)(C)CC5C4(C)CCC32)C)C1(C)C

Other Names for this Substance

  • 27-Norolean-14-en-3-one, 13-methyl-, (13α)-
  • Taraxerone
  • D-Friedoolean-14-en-3-one
  • (13α)-13-Methyl-27-norolean-14-en-3-one
  • Skimmione

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