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5,6-Dihy-droxy-7,8-di-meth-oxy-flavone.

サウスレア・インボルクラタ由来フラボン(5,6-ジヒドロキシ-7,8-ジメトキシフラボン)の結晶構造解析

other not specified not assessed

Abstract

A flavone compound with the molecular formula C17H14O6 was isolated from the petroleum ether-soluble fraction of the rare traditional Chinese medicinal herb Saussurea involucrata. X-ray crystallographic analysis revealed a nearly planar molecular geometry, with a dihedral angle of 1.89° between the benzopyranone ring system and the pendant phenyl group. The hydroxyl group at position 5 participates in a strong intramolecular hydrogen bond with the carbonyl oxygen, forming a six-membered ring motif. An additional intramolecular O–H···O contact was identified at the 6-hydroxy position. Within the crystal lattice, intermolecular O–H···O and C–H···O hydrogen bonds, together with π–π stacking interactions at distances of 3.37–3.39 Å, collectively establish a three-dimensional supramolecular network.

Bibliographic

Authors
Jing LL, Fan XF, Fan PC, He L, Jia ZP
Journal
Acta Crystallogr Sect E Struct Rep Online
Year
2013
PMID
24046658
DOI
10.1107/S1600536813014451
PMC
PMC3770373

Delivery context

The delivery route is not clearly identifiable from this paper. For hydrogen intake, inhalation is the most efficient route; inhalation, however, carries explosion risk (empirical LFL of 10%; high-concentration devices are not recommended).

Safety notes

The delivery route is not clearly identifiable from this paper. For hydrogen intake, inhalation is the most efficient route; inhalation, however, carries explosion risk (empirical LFL of 10%; high-concentration devices are not recommended).

See also:

Cite as: H2 Papers — PMID 24046658. https://h2-papers.org/en/papers/24046658
Source: PubMed PMID 24046658