2-O-(6-Deoxy-alpha-L-mannopyranosyl)-D-glucose

HCID 86933

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Basic information

CAS: 17074-02-1
Standard SMILES: C[C@@H]1O[C@@H](O[C@@H](C=O)[C@@H](O)[C@H](O)[C@H](O)CO)[C@H](O)[C@H](O)[C@H]1O
InChIKey: BQEBASLZIGFWEU-YMKBBEOCSA-N
Molecular formula: C12H22O10
Average molar mass: 326.3 g/mol
Monoisotopic mass: 326.12129689

Names & identifiers

Preferred name: 2-O-(6-Deoxy-alpha-L-mannopyranosyl)-D-glucose
IUPAC: (2R,3S,4R,5R)-3,4,5,6-tetrahydroxy-2-[(2S,3R,4R,5R,6S)-3,4,5-trihydroxy-6-methyloxan-2-yl]oxyhexanal
English name: Neohesperidose
Molecular formula: C12H22O10
Molecular weight: 326.3

Names & synonyms

2-O-(6-Deoxy-alpha-L-mannopyranosyl)-D-glucose(2R,3S,4R,5R)-3,4,5,6-tetrahydroxy-2-[(2S,3R,4R,5R,6S)-3,4,5-trihydroxy-6-methyloxan-2-yl]oxyhexanal(2R,3S,4R,5R)-3,4,5,6-Tetrahydroxy-2-(((2S,3R,4R,5R,6S)-3,4,5-trihydroxy-6-methyltetrahydro-2H-pyran-2-yl)oxy)hexanalorb1218648orb1707888SCHEMBL1976228BQEBASLZIGFWEU-YMKBBEOCSA-NHY-N7258EINECS 241-133-6MFCD000649192-O-alpha-l-rhamnopyranosyl-d-glucoseAKOS022181491

Show more names

NeohesperidoseNeohesperidose ,98%2-O-ALPHA-L-RHAMNOSYL-D-GLUCOSE2-0-alpha-L-rhamnosyl-D-glucose2-O-(6-Deoxy-α-L-mannopyranosyl)-D-glucose2-O-(6-deoxy-α-L-mannopyranosyl)-D-glucoseD-Glucose, 2-O-(6-deoxy-α-L-mannopyranosyl)-alpha-L-rhamnopyranosyl-(1->2)-beta-D-glucopyranose

CS-0110874NS00053685T13793(2R,3S,4R,5R)-3,4,5,6-tetrahydroxy-2-[(2S,3R,4R,5R,6S)-3,4,5-trihydroxy-6-methyl-tetrahydropyran-2-yl]oxy-hexanal

Database identifiers

CAS: 17074-02-1
PubChem CID: 86933
DTXSID: DTXSID20937829
Nikkaji: J15.268D

Properties

Computed structural properties

XLogP: -4.5
Topological polar surface area: 177 Å²
Hydrogen bond donors: 7
Hydrogen bond acceptors: 10
Rotatable bonds: 7
Heavy atoms: 22
Formal charge: 0
Complexity: 353

Physicochemical properties

Boiling point: 713.9 · 713.9±60.0 °C(Predicted)
Density: 1.58 · 1.58±0.1 g/cm3(Predicted)
pka: 12.92 · 12.92±0.70(Predicted)
LogP: -0.44 · -0.440 (est)
Safety Statements: 22 · 22-24/25
HS Code: 29329990 · 29329990

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

hs_code: 29329990
safety_code: 22-24/25

Chemistry & industry

Applications

UsesNeohesperidose is a disaccharide isolated from species oftypha[1].

Suppliers34 total

南京世洲生物科技有限公司025-85560043 15850508050 · [email protected]

成都普瑞法科技开发有限公司+86-028-82633397 18982077548 · [email protected]

銘瑞集團有限公司17318633522 · [email protected]

成都乐美天医药科技有限公司17308096051 17308096051 · [email protected]

成都超九八生物科技有限公司13348960310 13348960310 · [email protected]

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