Dracocephaloside, 7-(hydrogen sulfate), monopotassium salt
CAS Registry Number®
33530-70-0
CAS Name
Dracocephaloside, 7-(hydrogen sulfate), monopotassium saltMolecular Formula
C21H20O14S.KCite this Page
Dracocephaloside, 7-(hydrogen sulfate), monopotassium salt. CAS Common Chemistry. CAS, a division of the American Chemical Society, n.d. http://commonchemistry.cas.org/detail?cas_rn=33530-70-0 (retrieved ) (CAS RN: 33530-70-0). Licensed under the Attribution-Noncommercial 4.0 International License (CC BY-NC 4.0).Other Names and Identifiers
InChI
InChI=1S/C21H20O14S.K/c22-7-16-18(26)19(27)20(28)21(34-16)33-14-3-8(1-2-10(14)23)13-6-12(25)17-11(24)4-9(5-15(17)32-13)35-36(29,30)31;/h1-6,16,18-24,26-28H,7H2,(H,29,30,31);/t16-,18-,19+,20-,21-;/m1./s1
InChIKey
InChIKey=QJQUZHTXMRXDNC-NVADMLJHSA-N
SMILES
O=C1C=2C(OC(=C1)C3=CC(O[C@@H]4O[C@H](CO)[C@@H](O)[C@H](O)[C@H]4O)=C(O)C=C3)=CC(OS(=O)(=O)O)=CC2O.[K]
Canonical SMILES
[K].O=C1C=C(OC2=CC(OS(=O)(=O)O)=CC(O)=C12)C=3C=CC(O)=C(OC4OC(CO)C(O)C(O)C4O)C3
Other Names for this Substance
- Dracocephaloside, 7-(hydrogen sulfate), monopotassium salt