Emodic acid
CAS Registry Number®
478-45-5
CAS Name
Emodic acidMolecular Formula
C15H8O7Molecular Mass
300.22Cite this Page
Emodic acid. CAS Common Chemistry. CAS, a division of the American Chemical Society, n.d. http://commonchemistry.cas.org/detail?cas_rn=478-45-5 (retrieved ) (CAS RN: 478-45-5). Licensed under the Attribution-Noncommercial 4.0 International License (CC BY-NC 4.0).Compound Properties
Melting Point (1)
345-350 °C (decomp)
Source(s)
Other Names and Identifiers
InChI
InChI=1S/C15H8O7/c16-6-3-8-12(10(18)4-6)14(20)11-7(13(8)19)1-5(15(21)22)2-9(11)17/h1-4,16-18H,(H,21,22)
InChIKey
InChIKey=ZJXVNNSMRGTDBI-UHFFFAOYSA-N
SMILES
O=C1C=2C(C(=O)C=3C1=C(O)C=C(O)C3)=CC(C(O)=O)=CC2O
Canonical SMILES
O=C(O)C1=CC(O)=C2C(=O)C=3C(O)=CC(O)=CC3C(=O)C2=C1
Other Names for this Substance
- 2-Anthracenecarboxylic acid, 9,10-dihydro-4,5,7-trihydroxy-9,10-dioxo-
- 2-Anthroic acid, 9,10-dihydro-4,5,7-trihydroxy-9,10-dioxo-
- Emodic acid
- 9,10-Dihydro-4,5,7-trihydroxy-9,10-dioxo-2-anthracenecarboxylic acid
- NSC 624610