(4α,12β)-9,12-Dihydroxy-15-oxokauran-18-oic acid

CAS Registry Number®

1401419-89-3
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CAS Name

(4α,12β)-9,12-Dihydroxy-15-oxokauran-18-oic acid

Molecular Formula

C20H30O5

Molecular Mass

350.45

Cite this Page

(4α,12β)-9,12-Dihydroxy-15-oxokauran-18-oic acid.   CAS Common Chemistry.   CAS, a division of the American Chemical Society, n.d.   http://commonchemistry.cas.org/ChemicalDetail.aspx?ref=1401419-89-3 (retrieved 2024-04-28) (CAS RN: 1401419-89-3).  Licensed under the Attribution-Noncommercial 4.0 International License (CC BY-NC 4.0).

Other Names and Identifiers

InChI

InChI=1S/C20H30O5/c1-11-12-9-19(15(11)22)8-5-14-17(2,16(23)24)6-4-7-18(14,3)20(19,25)10-13(12)21/h11-14,21,25H,4-10H2,1-3H3,(H,23,24)/t11-,12-,13-,14-,17-,18-,19+,20-/m1/s1

InChIKey

InChIKey=IZIVAPRKBMMUKE-NBVFGAQYSA-N

SMILES

O[C@]12[C@]3(C[C@]([C@@H](C)C3=O)([C@H](O)C1)[H])CC[C@]4([C@@]2(C)CCC[C@]4(C(O)=O)C)[H]

Canonical SMILES

O=C(O)C1(C)CCCC2(C)C1CCC34C(=O)C(C)C(C3)C(O)CC42O

Other Names for this Substance

  • Kauran-18-oic acid, 9,12-dihydroxy-15-oxo-, (4α,12β)-
  • (4α,12β)-9,12-Dihydroxy-15-oxokauran-18-oic acid

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