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  2. 29883-15-6
Amygdalin | 29883-15-6

Product name:Amygdalin

CAS No:29883-15-6
MF:C20H27NO11
MW:457.4285
MDL:MFCD00006598
CID:53540
PubChem ID:24891046
Introduction

Amygdalin(Amygdalin),Also known as vitaminB17,Is made up of two moleculesglucoseAnd a molecule of amygdaline,The molecular formula isC20H27NO11.Amygdalin substances are non-toxic in themselves,But when they were β-Glucosidase metabolismdecompositionafter,Will produceToxicHydrocyanic acid.Experiments show that,The chemical properties of amygdalin are not active,Little impact on healthy tissues,Only invasion and destruction of cancer cells.The active ingredient of amygdalin is a naturally occurring cyanide,Are human metabolites,Can only play a role in cancer cells.In healthy liver\kidney\In spleen and leukocytes,Existingb-GlucosidaseAfter acting on amygdalin, cyanide andBenzaldehyde,Synergistic toxicity enhancement of the two.Highly toxic.Some people think it can control and prevent cancer.

Names and Identifiers
  • D(-)-Amygdalin hydrate
  • 6-O-BETA-D-GLUCOSIDO-BETA-D-GLUCOSIDE
  • AMYGDALIN
  • BENZENEACETONITRILE-[(6-O-BETA-D-GLUCOPYRANOSYL-BETA-D-GLUCOPYRANOSYL)OXY]-, (R)-
  • D(-)-AMYGDALIN
  • D-AMYGDALIN
  • D-MANDELONITRILE 6-O-BETA-D-GLUCOSIDO-BETA-D-GLUCOSIDE
  • D-MANDELONITRILE 6-O-BETA-D-GLUCOSIDO-BETA-D-GLUCOSIDE D-MANDELONITRILE BETA-GENTIOBIOSIDE
  • D-MANDELONITRILE-BETA-D-GLUCOSIDO-6-BETA-D-GLUCOSIDE
  • D-MANDELONITRILE-BETA-GENTIOBIOSIDE
  • GLUCOPRUNASIN
  • LAETRILE
  • MANDELONITRILE GENTIOBIOSIDE
  • (r)-alpha-((6-o-beta-d-glucopyranosyl-beta-d-glucopyranosyl)oxy)benzeneaceto
  • (r)-alpha-((6-o-beta-d-glucopyranosyl-beta-d-glucopyranosyl)oxy)benzeneacetonit
  • (r)-oxy)
  • (r)-y)
  • amygdaloside
  • benzeneacetonitrile,alpha-((6-o-beta-d-glucopyranosyl-beta-d-glucopyranosyl)
  • benzeneacetonitrile,alpha-((6-o-beta-d-glucopyranosyl-beta-d-glucopyranosyl)ox
  • AMYGDALIN(P)
  • D-AMYGLADIN
  • D-Mandelonitrile 6-O-β-D-glucosido-β-D-glucoside
  • D-Mandelonitrile-β-gentiobioside
  • Mygdalin
  • Nitrilosides
  • rile
  • vitamin b17
  • D-(-)-Amygdalin
  • (R)-Amygdalin
  • (R)-Amygdaloside
  • (R)-Laenitrile
  • (2R)-2-Phenyl-2-[(2R,3R,4S,5S,6R)-3,4,5-trihydroxy-6-[[(2R,3R,4S,5S,6R)-3,4,5-trihydroxy-6-(hydroxymethyl)oxan-2-yl]oxymethyl]oxan-2-y
  • [ "Amygdaloside", " Glucoprunasin" ]
  • D(-)-Mandelonitrile-beta-D-gentiobioside
  • 214UUQ9N0H
  • R-Amygdalin
  • Mandelonitrile-beta-gentiobioside
  • (2R)-[(6-O-beta-D-glucopyranosyl-beta-D-glucopyranosyl)oxy](phenyl)acetonitrile
  • (R)-2-phenyl-2-(((2R,3R,4S,5S,6R)-3,4,5-
  • Semen Armeniacae Amarum P.E
  • Amygdalin
  • CCG-269308
  • A820093
  • Mandelonitrile beta Gentiobioside
  • (-)-D-mandelonitrile beta-D-gentiobioside
  • HSDB 3559
  • D-(-)-mandelonitrile-beta-D-gentiobioside
  • 29883-15-6
  • AMYGDALIN [HSDB]
  • Benzeneacetonitrile, alpha-((6-O-beta-D-glucopyranosyl-beta-D-glucopyranosyl)oxy)-, (R)-
  • AMYGDALIN [WHO-DD]
  • DTXSID00897159
  • UNII-214UUQ9N0H
  • NSC251222
  • AMYGDALIN [MI]
  • MLS002473175
  • amygdalin
  • AC-27315
  • (2R)-((6-O-beta-D-glucopyranosyl-beta-D-glucopyranosyl)oxy)(phenyl)acetonitrile
  • bmse000139
  • EINECS 249-925-3
  • Amygdalin (Vitamin B17)
  • CHEBI:17019
  • NSC 15780
  • s2260
  • 5-17-08-00118 (Beilstein Handbook Reference)
  • SMR001397267
  • D-Amygdalin
  • NSC-15780
  • Vitamin B17
  • HMS2205O07
  • Benzeneacetonitrile,a-[(6-O-b-D-glucopyranosyl-b-D-glucopyranosyl)oxy]-, (aR)-
  • Amygdaloside
  • Mandelonitrile gentiobioside
  • (2R)-2-phenyl-2-[(2R,3R,4S,5S,6R)-3,4,5-trihydroxy-6-[[(2R,3R,4S,5S,6R)-3,4,5-trihydroxy-6-(hydroxymethyl)oxan-2-yl]oxymethyl]oxan-2-yl]oxyacetonitrile
  • (R)-alpha-((6-O-beta-D-Glucopyranosyl-beta-D-glucopyranosyl)oxy)benzeneacetonitrile
  • HY-N0190
  • XUCIJNAGGSZNQT-JHSLDZJXSA-N
  • NS00015336
  • AMY33421
  • CS-6162
  • (R)-2-phenyl-2-(((2R,3R,4S,5S,6R)-3,4,5-trihydroxy-6-((((2R,3R,4S,5S,6R)-3,4,5-trihydroxy-6-(hydroxymethyl)tetrahydro-2H-pyran-2-yl)oxy)methyl)tetrahydro-2H-pyran-2-yl)oxy)acetonitrile
  • (2R)-((6-O-.BETA.-D-GLUCOPYRANOSYL-.BETA.-D-GLUCOPYRANOSYL)OXY)(PHENYL)ACETONITRILE
  • BRN 0066856
  • CHEMBL461727
  • DTXCID701326581
  • AKOS016034288
  • SMP1_000103
  • SCHEMBL131406
  • D-Mandelonitrile-beta-D-glucosido-6-beta-D-glucoside
  • (R)-ALPHA-((6-O-BETA-D-GLUCOPYRANOSYL-BETA-D-GLUCOPYRANOSYL)OXY)BENZENEACETONITR ILE
  • C08325
  • Q410215
  • DS-7377
  • (R)-alpha-((6-O-beta-D-glucopyranosyl-beta-D- glucopyranosyl)oxy)benzeneacetonitrile
  • Benzeneacetonitrile, (R)-
  • CHEMBL2007233
  • NSC15780
  • Mandelonitrile-.beta.-gentiobioside
  • NCI60_001147
  • D(-)-Mandelonitrile-.beta.-D-gentiobioside
  • BCP28269
  • D-amygdalin
  • Benzeneacetonitrile, .alpha.-[(6-O-.beta.-D-glucopyranosyl-.beta.-D-glucopyranosyl)oxy]-, (R)-
  • D-mandelonitrile-beta-D-glucosido-6-beta-D-glucoside
  • Mandelonitrile ?-gentiobioside
  • Benzeneacetonitrile, .alpha.-((6-O-.beta.-D-glucopyranosyl-.beta.-D-glucopyranosyl)oxy)-, (R)-
  • (R)-amygdalin
  • Peach Kernel Extract
  • MDL:MFCD00006598
  • InChIKey:XUCIJNAGGSZNQT-JHSLDZJXSA-N
  • Inchi:1S/C20H27NO11/c21-6-10(9-4-2-1-3-5-9)30-20-18(28)16(26)14(24)12(32-20)8-29-19-17(27)15(25)13(23)11(7-22)31-19/h1-5,10-20,22-28H,7-8H2/t10-,11+,12+,13+,14+,15-,16-,17+,18+,19+,20+/m0/s1
  • SMILES:O1[C@]([H])([C@@]([H])([C@]([H])([C@@]([H])([C@@]1([H])C([H])([H])O[C@@]1([H])[C@@]([H])([C@]([H])([C@@]([H])([C@@]([H])(C([H])([H])O[H])O1)O[H])O[H])O[H])O[H])O[H])O[H])O[C@@]([H])(C#N)C1C([H])=C([H])C([H])=C([H])C=1[H]
  • BRN:0066856
Chemical and Physical Properties

Computed Properties

  • Exact Mass: 457.15800
  • Hydrogen Bond Donor Count: 7
  • Hydrogen Bond Acceptor Count: 12
  • Rotatable Bond Count: 7
  • Monoisotopic Mass: 457.158411
  • Topological Polar Surface Area: 202
  • Heavy Atom Count: 32
  • Formal charge: 0
  • Complexity: 638
  • Isotope Atom Count: 0
  • Defined Atom Stereocenter Count: 10
  • Undefined Atom Stereocenter Count : 1
  • Defined Bond Stereocenter Count: 0
  • Undefined Bond Stereocenter Count: 0
  • Covalently-Bonded Unit Count: 1
  • Functional 3D Acceptor Count: 12
  • Functional 3D ring Count: 3
  • Rotatable Bond Count: 9.4
  • isomeric RMSD: 1.2
  • CID conformational isomer Count: 189
  • XLogP3: -2.7
  • Functional 3D Donor Count: 7
  • Surface Charge: 0
  • Topological Polar Surface Area: 202
  • Molecular Weight: 457.4

Experimental Properties

  • LogP: -3.10802
  • PSA: 202.32000
  • Merck: 14,597
  • Refractive Index: -40 ° (C=2, H2O)
  • Water Partition Coefficient: 83G/L(25ºC)
  • Boiling Point: 563.27°C (rough estimate)
  • Melting Point: 223-226ºC
  • Flash Point: 403.3°C
  • Solubility: H2O: 0.1 g/mL hot, clear to very faintly turbid, colorless
  • Color/Form: Powder
  • Solubility: water
  • Specific Rotation: -38.5º(C=4,H2O)
  • Optical Activity: [α]20/D −39±2°, c = 2% in H2O
  • Density: 1.4474 (rough estimate)
Security Information
  • Symbol: GHS07
  • RTECS:OO8450000
  • WGK Germany:3
  • Safety Term:6.1(b)
  • Safety Instruction:S26; S36/37/39; S45
  • Packing Group:III
  • Packing Group:III
  • Risk Phrases:R22
  • Hazard Level:6.1(b)
  • Dấu hiệu hàng nguy hiểm: Xn Xn
  • Hazardous Material transportation number:2811
  • Hazard Statement:H302
  • Warning Statement:P264-P270-P301+P312+P330-P501
  • Prompt:warning
  • Storage Condition:Powder -20°C 3 years   4°C 2 years In solvent -80°C 6 months   -20°C 1 month
  • PackingGroup:III
  • Hazard Category Code:22
  • Signal Word:Warning
  • HazardClass:6.1(b)
  • FLUKA BRAND F CODES:10-21
Customs Data
  • HS CODE:customs code:29389090
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Brand:selleck Supplier:Selleck中国
No. Purity Stock Specification Price update time operate
S2260-100mg 98.29% 现货 100mg ¥3018.17 16 Sep. 2023
S2260-25mg 98.29% 现货 25mg ¥987.61 16 Sep. 2023
Brand:sigmaaldrich Supplier:西格玛奥德里奇(上海)贸易有限公司
No. Purity Stock Specification Price update time operate
A6005-25G 99% 25g ¥18736.88 28 Sep. 2023
A6005-5G 99% 5g ¥4822.28 28 Sep. 2023
A6005-1G 99% 1g ¥1665.81 28 Sep. 2023
10050-25G 97.0% 25g ¥3476.12 03 Oct. 2023
10050-5G 97.0% 5g ¥907.48 03 Oct. 2023
PHL89559-100MG 100mg ¥3048.57 14 Oct. 2023
Brand:aaron Supplier:Aaron
No. Purity Stock Specification Price update time operate
AR00I68E-500g 97% In China Stock 500g $419.00/ ¥3,043.28 14 Dec. 2023
AR00I68E-100g 97% In China Stock 100g $93.00/ ¥675.48 14 Dec. 2023
AR00I68E-25g 97% In China Stock 25g $30.00/ ¥217.90 14 Dec. 2023
AR00I68E-5g 97% In China Stock 5g $8.00/ ¥58.11 14 Dec. 2023
AR00I68E-1g 97% In China Stock 1g $5.00/ ¥36.32 14 Dec. 2023
Brand:sinophytochem Supplier:成都普思生物科技股份有限公司
No. Purity Stock Specification Price update time operate
PS0178-1000mg 98.0%(HPLC) 1000mg ¥ 300.0000 21 Sep. 2023
PU0355-25mg 98.5%(HPLC) 25mg ¥ 100.0000 21 Sep. 2023
PU0350-25mg N/A 25mg ¥ 130.0000 21 Sep. 2023
PS0178-1000 98.0%(HPLC) 1g 300.00 27 Mar. 2023
PU0355-0025 98.5%(HPLC) 25mg 100.00 27 Mar. 2023
PU0350-0025 N/A 25mg 130.00 27 Mar. 2023
Brand:targetmol Supplier:TargetMol Chemicals
No. Purity Stock Specification Price update time operate
T2795-100mg 100% 上海现货 100mg ¥ 330 15 Sep. 2023
T2795-20mg 100% 上海现货 20mg ¥ 100 15 Sep. 2023
T2795-1 mL * 10 mM (in DMSO) 100% 上海现货 1 mL * 10 mM (in DMSO) ¥ 150 15 Sep. 2023
T2795-100 mg 100% 上海现货 100MG ¥ 330 11 Jul. 2023
T2795-20 mg 100% 上海现货 20mg ¥ 100 11 Jul. 2023
Brand:enovation Supplier:eNovation Chemicals LLC
No. Purity Stock Specification Price update time operate
Y1291122-500g 97% 500g $515/ ¥3,740.55 04 Sep. 2023
Y1291122-100g 97% 100g $145/ ¥1,053.16 04 Sep. 2023
D630763-25g 97% 25g $980/ ¥7,117.94 04 Sep. 2023
D630763-5g 97% 5g $320/ ¥2,324.22 04 Sep. 2023
D511624-5g 97% 5g $200/ ¥1,452.64 13 May. 2023
Brand:lktlabs Supplier:LKT Labs
No. Purity Stock Specification Price update time operate
A5193-25 g ≥98% In stock 25g $343.50 / ¥2,494.91 11 Jul. 2023
A5193-5 g ≥98% In stock 5g $85.90 / ¥623.91 11 Jul. 2023
A5193-1 g ≥98% In stock 1g $57.20 / ¥415.46 11 Jul. 2023
Brand:alfa Supplier:阿法埃莎,赛默飞世尔科技旗下公司
No. Purity Stock Specification Price update time operate
L12731-10g 96% 10g ¥1593.00 16 Mar. 2023
L12731-2g 96% 2g ¥519.00 16 Mar. 2023
Brand:CityChemical Supplier:City Chemical
No. Purity Stock Specification Price update time operate
A4933-1GM 1gm $56.16/ ¥407.90 19 Sep. 2023
Brand:TCI Supplier:梯希爱(上海)化成工业发展有限公司
No. Purity Stock Specification Price update time operate
A0443-5G >97.0%(HPLC) 上海:/天津:/日本:≥40 5g ¥490.00 09 Sep. 2023
A0443-1G >97.0%(HPLC) 上海:1/天津:1/日本:21 1g ¥150.00 09 Sep. 2023
Brand:Key Organics Supplier:Key Organics Ltd
No. Purity Stock Specification Price update time operate
AS-14698-10MG >98% Usually 10 days 10mg £51.00/ ¥425.04 08 Sep. 2023
AS-14698-5MG >98% Usually 10 days 5mg £42.00/ ¥350.04 08 Sep. 2023
AS-14698-1MG >98% Usually 10 days 1mg £36.00/ ¥300.03 08 Sep. 2023
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