16β,17-Dihydroxy-ent-kauran-19-oic acid

CAS Registry Number®

3301-61-9
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CAS Name

16β,17-Dihydroxy-ent-kauran-19-oic acid

Molecular Formula

C20H32O4

Molecular Mass

336.47

Cite this Page

16β,17-Dihydroxy-ent-kauran-19-oic acid.   CAS Common Chemistry.   CAS, a division of the American Chemical Society, n.d.   http://commonchemistry.cas.org/ChemicalDetail.aspx?ref=3301-61-9 (retrieved 2024-04-29) (CAS RN: 3301-61-9).  Licensed under the Attribution-Noncommercial 4.0 International License (CC BY-NC 4.0).

Compound Properties

  • Melting Point (1)

    260-262 °C

Source(s)

Other Names and Identifiers

InChI

InChI=1S/C20H32O4/c1-17-7-3-8-18(2,16(22)23)14(17)6-9-19-10-13(4-5-15(17)19)20(24,11-19)12-21/h13-15,21,24H,3-12H2,1-2H3,(H,22,23)/t13-,14+,15+,17-,18-,19+,20+/m1/s1

InChIKey

InChIKey=MRBLTWPEPGRXQN-INIPNLRTSA-N

SMILES

C[C@]12[C@]3([C@@]4(C[C@@](CO)(O)[C@@](C4)(CC3)[H])CC[C@@]1([C@@](C(O)=O)(C)CCC2)[H])[H]

Canonical SMILES

O=C(O)C1(C)CCCC2(C)C1CCC34CC(CCC32)C(O)(CO)C4

Other Names for this Substance

  • Kauran-18-oic acid, 16,17-dihydroxy-, (4α)-
  • Kauran-18-oic acid, 16,17-dihydroxy-
  • (4α)-16,17-Dihydroxykauran-18-oic acid
  • 16,17-Dihydroxy-16β-(-)-kauran-19-oic acid
  • (-)-16,17-Dihydroxy-16β-kauran-19-oic acid

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Deleted or Replaced CAS Registry Numbers

870250-38-7, 874150-53-5, 2139370-63-9

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