Grandifloric acid
CAS Registry Number®
22338-69-8
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CAS Name
Grandifloric acidMolecular Formula
C20H30O3Molecular Mass
318.45Cite this Page
Grandifloric acid. CAS Common Chemistry. CAS, a division of the American Chemical Society, n.d. http://commonchemistry.cas.org/ChemicalDetail.aspx?ref=22338-69-8 (retrieved ) (CAS RN: 22338-69-8). Licensed under the Attribution-Noncommercial 4.0 International License (CC BY-NC 4.0).Compound Properties
Melting Point (1)
226-228 °C
Source(s)
Other Names and Identifiers
InChI
InChI=1S/C20H30O3/c1-12-13-5-6-15-18(2)8-4-9-19(3,17(22)23)14(18)7-10-20(15,11-13)16(12)21/h13-16,21H,1,4-11H2,2-3H3,(H,22,23)/t13-,14+,15+,16+,18-,19-,20-/m1/s1
InChIKey
InChIKey=GVGJRXSJJHLPGZ-DZAVYMGKSA-N
SMILES
O[C@@H]1[C@]23[C@]([C@@]4(C)[C@](CC2)([C@@](C(O)=O)(C)CCC4)[H])(CC[C@](C3)(C1=C)[H])[H]
Canonical SMILES
O=C(O)C1(C)CCCC2(C)C1CCC34CC(C(=C)C3O)CCC24
Other Names for this Substance
- Kaur-16-en-18-oic acid, 15-hydroxy-, (4α,15α)-
- Kaur-16-en-18-oic acid, 15α-hydroxy-
- (4α,15α)-15-Hydroxykaur-16-en-18-oic acid
- Grandiflorolic acid
- 15α-Hydroxykaur-16-en-19-oic acid
Deleted or Replaced CAS Registry Numbers
51956-37-7
