Stearyl glycyrrhetinate

CAS Registry Number®

13832-70-7
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CAS Name

Stearyl glycyrrhetinate

Molecular Formula

C48H82O4

Molecular Mass

723.16

Cite this Page

Stearyl glycyrrhetinate.   CAS Common Chemistry.   CAS, a division of the American Chemical Society, n.d.   http://commonchemistry.cas.org/ChemicalDetail.aspx?ref=13832-70-7 (retrieved 2024-05-04) (CAS RN: 13832-70-7).  Licensed under the Attribution-Noncommercial 4.0 International License (CC BY-NC 4.0).

Compound Properties

  • Melting Point (1)

    116-118 °C

Source(s)

Other Names and Identifiers

InChI

InChI=1S/C48H82O4/c1-9-10-11-12-13-14-15-16-17-18-19-20-21-22-23-24-33-52-42(51)45(5)30-29-44(4)31-32-47(7)36(37(44)35-45)34-38(49)41-46(6)27-26-40(50)43(2,3)39(46)25-28-48(41,47)8/h34,37,39-41,50H,9-33,35H2,1-8H3/t37-,39-,40-,41+,44+,45-,46-,47+,48+/m0/s1

InChIKey

InChIKey=WNIFXKPDILJURQ-JKPOUOEOSA-N

SMILES

C[C@]12[C@@]3(C)[C@@]([C@]4(C)[C@@](CC3)(C(C)(C)[C@@H](O)CC4)[H])(C(=O)C=C1[C@]5([C@@](C)(CC2)CC[C@@](C(OCCCCCCCCCCCCCCCCCC)=O)(C)C5)[H])[H]

Canonical SMILES

O=C(OCCCCCCCCCCCCCCCCCC)C1(C)CCC2(C)CCC3(C(=CC(=O)C4C5(C)CCC(O)C(C)(C)C5CCC43C)C2C1)C

Other Names for this Substance

  • Olean-12-en-29-oic acid, 3-hydroxy-11-oxo-, octadecyl ester, (3β,20β)-
  • Olean-12-en-30-oic acid, 3β-hydroxy-11-oxo-, octadecyl ester
  • Stearyl glycyrrhetinate
  • α-Glycyrrhetinic acid stearyl ester
  • n-Octadecyl glycyrrhetinate

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Deleted or Replaced CAS Registry Numbers

34348-57-7, 153953-28-7

CAS INSIGHTSTM
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