Basic information
- CAS
7772-79-4- Standard SMILES
CC(=O)N[C@H]1[C@H](OC(C)=O)O[C@H](COC(C)=O)[C@@H](OC(C)=O)[C@@H]1OC(C)=O- InChIKey
OVPIZHVSWNOZMN-OXGONZEZSA-N- Molecular formula
- C16H23NO10
- Average molar mass
- 389.35 g/mol
- Monoisotopic mass
- 389.13219593
Names & identifiers
- Preferred name
- N-Acetyl-beta-D-glucosamine tetraacetate
- IUPAC
- [(2R,3S,4R,5R,6S)-5-acetamido-3,4,6-triacetyloxyoxan-2-yl]methyl acetate
- English name
- beta-D-Glucosamine pentaacetate
- Molecular formula
- C16H23NO10
- Molecular weight
- 389.35
Names & synonyms
7772-79-4N-Acetyl-beta-D-glucosamine tetraacetateEINECS 231-865-4NSC 224432RefChem:363085231-865-42-Acetamido-1,3,4,6-tetra-O-acetyl-2-deoxy-beta-D-glucopyranoseb-D-Glucosamine Pentaacetatebeta-D-Glucosamine pentaacetateMFCD00006595Glc-N-Ac freePentaacetyl-beta-D-glucosamine
Show more names
1,3,4,6-tetra-O-acetyl-2-deoxy-2-acetamido-β-D-glucopyranose2-ACETAMIDO-2-DEOXY-BETA-D-GLUCOPYRANOSE2-Acetamido-2-deoxy-á-d-glucosamine pentaacetateβ-D-Glucosamine pentaacetateBETA-D-GLUCOSAMIN-PENTAACETATSS-D-GLUCOSAMINE PENTAACETATE
section sign-D-Glucosamine pentaacetateC16H23NO101,2,3,4,6-Penta-O-acetyl-b-D-glucosamine2-acetamido-2-deoxy-beta-d-glucose tetracetate(2S,3R,4R,5S,6R)-3-acetamido-6-(acetoxymethyl)tetrahydro-2H-pyran-2,4,5-triyl triacetate[(2R,3S,4R,5R,6S)-3,4,6-TRIS(ACETYLOXY)-5-ACETAMIDOOXAN-2-YL]METHYL ACETATE[(2R,3S,4R,5R,6S)-5-acetamido-3,4,6-triacetoxy-tetrahydropyran-2-yl]methyl acetate.beta.-D-Glucosamine Pentaacetate
Properties
Computed structural properties
- XLogP
- 0.1
- Topological polar surface area
- 144 Ų
- Hydrogen bond donors
- 1
- Hydrogen bond acceptors
- 10
- Rotatable bonds
- 10
- Heavy atoms
- 27
- Formal charge
- 0
- Complexity
- 604
Physicochemical properties
- Melting point
- 186 · 186-189 °C(lit.)
- Boiling point
- 530.2 · 530.2±50.0 °C(Predicted)
- Density
- 1.3 · 1.30±0.1 g/cm3(Predicted)
- refractive index
- 2 ° · 2 ° (C=5, CHCl3)
- storage temp.
- 2 · Sealed in dry,2-8°C
- solubility
- Chloroform (Slightly, Heated, Sonicated), Methanol (Slightly, Heated, Sonicated)
- pka
- 13.41 · 13.41±0.70(Predicted)
- form
- Solid
- color
- White to Light Brown
- optical activity
- 24 · [α]24/D +1.7 to +3.0°, c = 10 in chloroform
- BRN
- 98835 · 98835
- InChI
- 1S/C16H23NO10/c1-7(18)17-13-15(25-10(4)21)14(24-9(3)20)12(6-23-8(2)19)27-16(13)26-11(5)22/h12-16H,6H2,1-5H3,(H,17,18)/t12-,13-,14-,15-,16-/m1/s1
- InChIKey
- OVPIZHVSWNOZMN-OXGONZEZSA-N
- SMILES
- CC(=O)N[C@H]1[C@@H](O[C@H](COC(C)=O)[C@@H](OC(C)=O)[C@@H]1OC(C)=O)OC(C)=O
Safety & regulation
Safety information is for reference only and does not replace the supplier’s Safety Data Sheet (SDS), applicable regulations, or professional assessment.
GHS classification
GHS Classification
Warning
H315 (100%): Causes skin irritation [Warning Skin corrosion/irritation]
P261, P264, P264+P265, P271, P280, P302+P352, P304+P340, P305+P351+P338, P319, P321, P332+P317, P337+P317, P362+P364, P403+P233, P405, and P501 (click each P-code to see the statement)
The GHS information provided by 1 company from 1 notification to the ECHA C&L Inventory.
Hazard information
Regulatory Information.beta.-D-Glucopyranose, 2-(acetylamino)-2-deoxy-, 1,3,4,6-tetraacetate: Does not have an individual approval but may be used under an appropriate group standard
Hazard Classes and CategoriesSkin Irrit. 2 (100%)
Safety data
- wgk
- 3
- hs_code
- 29329990
- Signal word
- Warning
- Symbol(GHS)
- GHS07
- safety_code
- 24/25
- Storage Class
- 11 - Combustible Solids
- Hazard statements
- H315-H319-H335
- Precautionary statements
- P261-P305+P351+P338
Chemistry & industry
Applications
Usesβ-D-Glucosamine Pentaacetate is an N-acetylglucosamine derivative that has been shown to promote hyaluronic acid production.
UsesAn N-acetylglucosamine derivatives as promoters for hyaluronic acid production.
Suppliers100 total
梯希爱(上海)化成工业发展有限公司021-67121386 · [email protected]
上海阿拉丁生化科技股份有限公司400-6206333 13167063860 · [email protected]
武汉英诺医药科技有限公司+86-027-59232304 15387063101 · [email protected]
爱斯特（成都）生物制药股份有限公司+86-28-85122536 85324413 · [email protected]
南京世洲生物科技有限公司025-025-85560043 17301488900 · [email protected]
韶远科技（上海）有限公司4000665055 · [email protected]
科瑞迪化学400-821-5857 021-64326257 · [email protected]
南京百芙利科技有限责任公司25-25-58740604 15951658055 · [email protected]
毕佳索（上海毕得医药科技股份有限公司）400-6005915 · [email protected]
Ark Pharm, Inc.847-367-3680 · [email protected]
上海迈瑞尔生化科技有限公司4006356688 18621169109 · [email protected]
Related reactions
1 records
Compound notes
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