CAS 3681-93-4 MFCD00017456-Vitexin 5,7-二羟基-2-(4-羟基苯基)-8-((2S,3R,4R,5S,6R)-3,4,5-三羟基-6-(羟甲基)四氢-2H-吡喃-2-基)-4H-苯并吡喃-4-酮 TAO{mole}

Vitexin 5,7-二羟基-2-(4-羟基苯基)-8-((2S,3R,4R,5S,6R)-3,4,5-三羟基-6-(羟甲基)四氢-2H-吡喃-2-基)-4H-苯并吡喃-4-酮

CAS 3681-93-4 MFCD00017456

化学结构图

SMILES: O=c1cc(-c2ccc(O)cc2)oc2c([C@@H]3O[C@H](CO)[C@@H](O)[C@H](O)[C@H]3O)c(O)cc(O)c12

化学属性

Mol. Formula	C21H20O10
Mol. Weight	432
Density	1.686
Boiling Point
Melting Point

别名和识别编码

Chemical Name	5,7-Dihydroxy-2-(4-Hydroxyphenyl)-8-((2S,3R,4R,5S,6R)-3,4,5-Trihydroxy-6-(Hydroxymethyl)Tetrahydro-2H-Pyran-2-Yl)-4H-Chromen-4-One
MDL Number	MFCD00017456
PubChem Substance ID	5280441
Beilstein Registry Number	67796
CAS Number	3681-93-4
EC Number	222-963-8
Synonym	8-glycosyl-apigenin 8-glycosylapigenin apigenin 8-C-glucoside vitexin
Chemical Name Translation	5,7-二羟基-2-(4-羟基苯基)-8-((2S,3R,4R,5S,6R)-3,4,5-三羟基-6-(羟甲基)四氢-2H-吡喃-2-基)-4H-苯并吡喃-4-酮
LabNetwork Molecule ID	LN01327612
InChI	InChI=1S/C21H20O10/c22-7-14-17(27)18(28)19(29)21(31-14)16-11(25)5-10(24)15-12(26)6-13(30-20(15)16)8-1-3-9(23)4-2-8/h1-6,14,17-19,21-25,27-29H,7H2/t14-,17-,18+,19-,21+/m1/s1

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分类

{SNA} Acacia,
{SNA} Alphabetical Index of Phytochemical S
{SNA} Acacia, Additional Standards, Alphabetical Index of Phytochemical Standards, Analytical Standards, Cannabis, Capsicum, Chemical Class, Chromatography, Crataegus, Flavonoids, Flavonoids (Catechins), Glycine, Glycyrrhiza, Humulus, Lavandula, Life Sciences Standards, Linum usitatissimum (Flax), Natural Compounds, Ononis, Passiflora, Phytochemical Standards, Phytochemical Standards by Plant Genus, Phytochemicals by Plant (Food/Spice/Herb), Polygonum, S - Z,

安全信息

WGK Germany3

Personal Protective Equipment Eyeshields, Gloves, type N95 (US), type P1 (EN143) respirator filter

RTECSDJ2984000

GHS Symbol

Precautionary statements

TYPE OF TEST            : LD25 - Lethal Dose
ROUTE OF EXPOSURE       : Intraperitoneal
SPECIES OBSERVED        : Rodent - mouse
DOSE/DURATION           : 1 mg/kg
TOXIC EFFECTS :
   Details of toxic effects not reported other than lethal dose value
REFERENCE :
   PLMEAA Planta Medica.  (Georg Thieme Verlag, Postfach 732, D-7000 Stuttgart
   1, Fed. Rep. Ger.) V.1-    1953-  Volume(issue)/page/year: 43,396,1981

TYPE OF TEST            : Sister chromatid exchange
TEST SYSTEM             : Human Lymphocyte
DOSE/DURATION           : 50 mg/L
REFERENCE :
   MUREAV Mutation Research.  (Elsevier Science Pub. B.V., POB 211, 1000 AE
   Amsterdam, Netherlands) V.1-    1964-  Volume(issue)/page/year: 246,205,1991

TYPE OF TEST            : Micronucleus test
TEST SYSTEM             : Human Lymphocyte
DOSE/DURATION           : 50 mg/L
REFERENCE :
   MUREAV Mutation Research.  (Elsevier Science Pub. B.V., POB 211, 1000 AE
   Amsterdam, Netherlands) V.1-    1964-  Volume(issue)/page/year: 246,205,1991

TYPE OF TEST            : Sex chromosome loss and nondisjunction
TEST SYSTEM             : Human Lymphocyte
DOSE/DURATION           : 200 mg/L
REFERENCE :
   MUREAV Mutation Research.  (Elsevier Science Pub. B.V., POB 211, 1000 AE
   Amsterdam, Netherlands) V.1-    1964-  Volume(issue)/page/year: 246,205,1991

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