Troxerutin structure

Troxerutin

2-[3,4-bis(2-hydroxyethoxy)phenyl]-5-hydroxy-7-(2-hydroxyethoxy)-3-[3,4,5-trihydroxy-6-[(3,4,5-trihydroxy-6-methyloxan-2-yl)oxymethyl]oxan-2-yl]oxychromen-4-one

Also Known As: Troxerutin|Pherarutin|Posorutin|Troksevazin|Troxarutin|Troxerutine|Helveton|Venaroid|Venoruton|Flebil|Venoruton P4|oxerutin|Trihydroxyethylrutin|Troxerutina|Troxerutinum|Troxevazin|Veinamitol|Pur-Rutin|Vastribil|Alkanol|Paroven|Relvene|Veniten|Factor P-zyma|Veinamitol Pulver|Ruven|Trioxyethylrutin|Rufen-P4|Vitamin P4|Veno SL|Troxarutin-ratiopharm|Tris(hydroxyethyl)rutin|Trihydroxyethylrutoside|Troxerutin [M+H]+|trihydroxyethyl rutoside|Tris(hydroxyethyl)rutoside|Troxerutine [INN-French]|Troxerutinum [INN-Latin]|Troxerutina [INN-Spanish]|Troxerutin [INN:BAN:DCF]|Trihydroxyethylrutoside [French]|3',4',7-Tris(hydroxyethyl)rutin|Troxerutin [BAN:DCF:INN]|3',4',7-trihydroxyethylrutin

CAS: 7085-55-4
Molecular Formula C33H42O19
Molecular Weight 742.23206 g/mol
LogP -2.6906
Topological Polar Surface Area 297.12 Ų
Hydrogen Bond Donors 10
Hydrogen Bond Acceptors 19
Rotatable Bonds 15
Exact Mass 742.23206
Monoisotopic Mass 742.23206
Heavy Atoms 52
Complexity 1697.9766

Chemical Identifiers

CAS Number 7085-55-4
SMILES CC1C(C(C(C(O1)OCC2C(C(C(C(O2)OC3=C(OC4=CC(=CC(=C4C3=O)O)OCCO)C5=CC(=C(C=C5)OCCO)OCCO)O)O)O)O)O)O

Product Overview

Troxerutin (CAS 7085-55-4), with molecular formula C33H42O19 and molecular weight 742.23206 g/mol. IUPAC: 2-[3,4-bis(2-hydroxyethoxy)phenyl]-5-hydroxy-7-(2-hydroxyethoxy)-3-[3,4,5-trihydroxy-6-[(3,4,5-trihydroxy-6-methyloxan-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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