Kakkanin structure

Kakkanin

5-hydroxy-3-(4-methoxyphenyl)-7-[3,4,5-trihydroxy-6-[(3,4,5-trihydroxyoxan-2-yl)oxymethyl]oxan-2-yl]oxychromen-4-one

Also Known As: Kakkanin|5-hydroxy-3-(4-methoxyphenyl)-7-[3,4,5-trihydroxy-6-[(3,4,5-trihydroxyoxan-2-yl)oxymethyl]oxan-2-yl]oxy-chromen-4-one|5-hydroxy-3-(4-methoxyphenyl)-7-[3,4,5-trihydroxy-6-[(3,4,5-trihydroxyoxan-2-yl)oxymethyl]oxan-2-yl]oxychromen-4-one|BIOCHANIN A 7-O-B-D-XYLOPYRANOSYL,B-D-GLUCOPYRANOSIDE|5-Hydroxy-3-(4-methoxyphenyl)-4-oxo-4H-1-benzopyran-7-yl 6-O-pentopyranosylhexopyranoside|5-hydroxy-3-(4-methoxyphenyl)-7-[3,4,5-trihydroxy-6-[(3,4,5-trihydroxytetrahydropyran-2-yl)oxymethyl]tetrahydropyran-2-yl]oxy-chromen-4-one|N/A

CAS: 63770-91-2
Molecular Formula C27H30O14
Molecular Weight 578.1636 g/mol
LogP -1.1838
Topological Polar Surface Area 217.97 Ų
Hydrogen Bond Donors 7
Hydrogen Bond Acceptors 14
Rotatable Bonds 7
Exact Mass 578.1636
Monoisotopic Mass 578.1636
Heavy Atoms 41
Complexity 1407.6287

Chemical Identifiers

CAS Number 63770-91-2
SMILES COC1=CC=C(C=C1)C2=COC3=CC(=CC(=C3C2=O)O)OC4C(C(C(C(O4)COC5C(C(C(CO5)O)O)O)O)O)O

Product Overview

Kakkanin (CAS 63770-91-2), with molecular formula C27H30O14 and molecular weight 578.1636 g/mol. IUPAC: 5-hydroxy-3-(4-methoxyphenyl)-7-[3,4,5-trihydroxy-6-[(3,4,5-trihydroxyoxan-2-yl)oxymethyl]oxan-2-yl]oxychromen-4-one.

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Safety Data Sheet (MSDS / SDS) View the Laboratory Chemical Safety Summary (LCSS) on PubChem — includes GHS classifications, hazard statements, first aid measures, and handling precautions.
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