Basic information
- CAS
66580-68-5- Standard SMILES
O=C[C@H](O[C@@H]1O[C@H](CO)[C@H](O)[C@H](O)[C@H]1O)[C@@H](O[C@H]1O[C@H](CO)[C@H](O)[C@H](O)[C@H]1O)[C@H](O)[C@H](O)CO- InChIKey
OXEVOBRQLSFMMV-MQGWWLBPSA-N- Molecular formula
- C18H32O16
- Average molar mass
- 504.4 g/mol
- Monoisotopic mass
- 504.16903493
Names & identifiers
- Preferred name
- Globotriose
- IUPAC
- (2R,3S,4R,5R)-4,5,6-trihydroxy-2-[(2S,3R,4S,5R,6R)-3,4,5-trihydroxy-6-(hydroxymethyl)oxan-2-yl]oxy-3-[(2R,3R,4S,5R,6R)-3,4,5-trihydroxy-6-(hydroxymethyl)oxan-2-yl]oxyhexanal
- English name
- Globotriose
- Molecular formula
- C18H32O16
- Molecular weight
- 504.44
Names & synonyms
GlobotriaoseP(k) TrisaccharideGalp-1-4-galp-glcpGal-1-4-gal-1-4-glcRefChem:14348366580-68-5GlobotrioseGalalpha1-4Galbeta1-4Glc(2R,3S,4R,5R)-4,5,6-trihydroxy-2-[(2S,3R,4S,5R,6R)-3,4,5-trihydroxy-6-(hydroxymethyl)oxan-2-yl]oxy-3-[(2R,3R,4S,5R,6R)-3,4,5-trihydroxy-6-(hydroxymethyl)oxan-2-yl]oxyhexanalSCHEMBL29572954DTXSID50985176Hexopyranosyl-(1->2)-[hexopyranosyl-(1->3)]hexose
Show more names
pK antigenGlobotrinoseD-GlobotrioseGlobotriose ,98%Globotriose (Gb3)GAL-ALPHA1-4GAL-BETA1-4GLCGlobotriose (Gb3) (>98% HPLC)Globotriaose (Gb3) / Pk antigen
alpha-D-galactopyranosyl-(1->3)-[beta-D-galactopyranosyl-(1->2)]-D-glucose
Database identifiers
Properties
Computed structural properties
- XLogP
- -6.6
- Topological polar surface area
- 277 Ų
- Hydrogen bond donors
- 11
- Hydrogen bond acceptors
- 16
- Rotatable bonds
- 11
- Heavy atoms
- 34
- Formal charge
- 0
- Complexity
- 625
Physicochemical properties
- Boiling point
- 958.9 · 958.9±65.0 °C(Predicted)
- Density
- 1.75 · 1.75±0.1 g/cm3(Predicted)
- storage temp.
- 2 · 2-8°C
- pka
- 12.39 · 12.39±0.20(Predicted)
- Symbol(GHS)
- 7 · GHS07
- Signal word
- Warning
- Hazard statements
- 315 · H315-H319-H335
- Precautionary statements
- 280 · P280-P302+P352-P362+P364
- WGK Germany
- 3 · 3
- HS Code
- 2940000080 · 2940000080
Safety & regulation
Safety information is for reference only and does not replace the supplier’s Safety Data Sheet (SDS), applicable regulations, or professional assessment.
Safety data
- wgk
- 3
- hs_code
- 2940000080
- Signal word
- Warning
- Symbol(GHS)
- GHS07
- Hazard statements
- H315-H319-H335
- Precautionary statements
- P280-P302+P352-P362+P364
Chemistry & industry
Applications
UsesGlobotriose can be used as biomarkers for predicting and or detecting immune response to cancer vaccine in patients with cancer or prostate cancer
Suppliers28 total
湖南韵邦生物科技股份有限公司0731-88532326 13319508186 · [email protected]
陕西星贝爱科生物科技有限责任公司029-13572876172 13572876172 · [email protected]
南京世洲生物科技有限公司025-025-85560043 17301488900 · [email protected]
浙江珲达生物科技有限公司0571-89903022 18679456698 · [email protected]
上海赛可锐生物科技有限公司021-58000709 13120558703 · [email protected]
上海维亦特生物科技有限公司15317051735 · [email protected]
杭州璟皓生物科技有限公司（原河南辛迪加生物）17513242016 · [email protected]
南京世洲生物科技有限公司13675144456 · [email protected]
BOC Sciences16314854226 · [email protected]
资川生化科技(苏州)有限公司0512-66317708 13372112871 · [email protected]
韶远科技(上海)有限公司4000665055 · [email protected]
上海艾康睿医药科技有限公司021-33730573 15821573036 · [email protected]
Related reactions
0 records
No reaction records under the current filter.
Compound notes
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