Deoxyloganic acid
CAS Registry Number®
22487-36-1
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CAS Name
Deoxyloganic acidMolecular Formula
C16H24O9Molecular Mass
360.36Cite this Page
Deoxyloganic acid. CAS Common Chemistry. CAS, a division of the American Chemical Society, n.d. http://commonchemistry.cas.org/ChemicalDetail.aspx?ref=22487-36-1 (retrieved ) (CAS RN: 22487-36-1). Licensed under the Attribution-Noncommercial 4.0 International License (CC BY-NC 4.0).Compound Properties
Melting Point (1)
88-90 °C
Source(s)
Other Names and Identifiers
InChI
InChI=1S/C16H24O9/c1-6-2-3-7-8(14(21)22)5-23-15(10(6)7)25-16-13(20)12(19)11(18)9(4-17)24-16/h5-7,9-13,15-20H,2-4H2,1H3,(H,21,22)/t6-,7+,9+,10+,11+,12-,13+,15-,16-/m0/s1
InChIKey
InChIKey=DSXFHNSGLYXPNG-YDYVGBNJSA-N
SMILES
O([C@H]1[C@]2([C@@](C(C(O)=O)=CO1)(CC[C@@H]2C)[H])[H])[C@@H]3O[C@H](CO)[C@@H](O)[C@H](O)[C@H]3O
Canonical SMILES
O=C(O)C1=COC(OC2OC(CO)C(O)C(O)C2O)C3C1CCC3C
Other Names for this Substance
- Cyclopenta[c]pyran-4-carboxylic acid, 1-(β-D-glucopyranosyloxy)-1,4a,5,6,7,7a-hexahydro-7-methyl-, (1S,4aS,7S,7aR)-
- Cyclopenta[c]pyran-4-carboxylic acid, 1α-(β-D-glucopyranosyloxy)-1,4aα,5,6,7,7aα-hexahydro-7α-methyl-
- Cyclopenta[c]pyran-4-carboxylic acid, 1-(β-D-glucopyranosyloxy)-1,4a,5,6,7,7a-hexahydro-7-methyl-, [1S-(1α,4aα,7α,7aα)]-
- (1S,4aS,7S,7aR)-1-(β-D-Glucopyranosyloxy)-1,4a,5,6,7,7a-hexahydro-7-methylcyclopenta[c]pyran-4-carboxylic acid
- 7-Deoxyloganic acid
Deleted or Replaced CAS Registry Numbers
11030-58-3, 22487-11-2, 28254-47-9, 31697-40-2
