![Quinic acid[奎尼酸]](https://newcny.com/wp-content/uploads/2024/07/77-95-2.svg)
CAS Registry Number®
77-95-2
CAS Name
(-)-Quinic acid
Molecular Formula
C7H12O6
Molecular Mass
192.17
Compound Properties
-
Melting Point (1)
162.5 °C
Source(s)
- (1) PhysProp data were obtained from Syracuse Research Corporation of Syracuse, New York (US)
Other Names and Identifiers
InChI
InChI=1S/C7H12O6/c8-3-1-7(13,6(11)12)2-4(9)5(3)10/h3-5,8-10,13H,1-2H2,(H,11,12)/t3-,4-,5-,7+/m1/s1
InChIKey
InChIKey=AAWZDTNXLSGCEK-WYWMIBKRSA-N
SMILES
C(O)(=O)[C@]1(O)C[C@@H](O)[C@@H](O)[C@H](O)C1
Canonical SMILES
O=C(O)C1(O)CC(O)C(O)C(O)C1
Other Names for this Substance
- Cyclohexanecarboxylic acid, 1,3,4,5-tetrahydroxy-, (1α,3R,4α,5R)-
- Cyclohexanecarboxylic acid, 1,3,4,5-tetrahydroxy-, (-)-
- Cyclohexanecarboxylic acid, 1,3,4,5-tetrahydroxy-, [1R-(1α,3α,4α,5β)]-
- (1α,3R,4α,5R)-1,3,4,5-Tetrahydroxycyclohexanecarboxylic acid
- D-Quinic acid
- (-)-Quinic acid
- D-(-)-Quinic acid
- Quinic acid
- Quinic acid, (-)-
- MeSH ID: D011801
Deleted or Replaced CAS Registry Numbers
35949-55-4
