Basic information
- CAS
176299-96-0- Standard SMILES
COc1ccc(O[C@@H]2O[C@H]3COC(c4ccccc4)O[C@@H]3[C@H](O)[C@@H]2O)cc1- InChIKey
YHRLBNMWLPNUFF-GLNIJSSQSA-N- Molecular formula
- C20H22O7
- Average molar mass
- 374.4 g/mol
- Monoisotopic mass
- 374.13655304
Names & identifiers
- Preferred name
- (4aS,6S,7S,8R,8aR)-6-(4-methoxyphenoxy)-2-phenyl-4,4a,6,7,8,8a-hexahydropyrano[3,2-d][1,3]dioxine-7,8-diol
- IUPAC
- (4aS,6S,7S,8R,8aR)-6-(4-methoxyphenoxy)-2-phenyl-4,4a,6,7,8,8a-hexahydropyrano[3,2-d][1,3]dioxine-7,8-diol
- English name
- 4-Methoxyphenyl 4,6-O-Benzylidene-beta-D-galactopyranoside
- Molecular formula
- C20H22O7
- Molecular weight
- 374.39
Names & synonyms
176299-96-04-Methoxyphenyl 4,6-O-Benzylidene-beta-D-galactopyranoside(4aS,6S,7S,8R,8aR)-6-(4-methoxyphenoxy)-2-phenyl-4,4a,6,7,8,8a-hexahydropyrano[3,2-d][1,3]dioxine-7,8-diol4-Methoxyphenyl 4,6-O-Benzylidene-b-D-galactopyranosideDTXSID00693678MM606064-Methoxyphenyl 4,6-O-benzylidene-alpha-L-allopyranoside4-Methoxyphenyl 4,6-O-benzylidene-β-D-galactopyranoside4-Methoxy1phenyl 4,6-O-Benzylidene-beta-D-galactopyranosideb-D-Galactopyranoside,4-methoxyphenyl 4,6-O-[(S)-phenylmethylene]-β-D-Galactopyranoside, 4-methoxyphenyl 4,6-O-[(S)-phenylmethylene]-(4AR,6S,7R,8R,8aR)-6-(4-methoxyphenoxy)-2-phenylhexahydropyrano[3,2-d][1,3]dioxine-7,8-diol
Show more names
(2S,4aR,6S,7R,8R,8aR)-6-(4-methoxyphenoxy)-2-phenylhexahydropyrano[3,2-d][1,3]dioxine-7,8-diol - [AC80937]
Properties
Computed structural properties
- XLogP
- 1.7
- Topological polar surface area
- 86.6 Ų
- Hydrogen bond donors
- 2
- Hydrogen bond acceptors
- 7
- Rotatable bonds
- 4
- Heavy atoms
- 27
- Formal charge
- 0
- Complexity
- 461
Physicochemical properties
- Melting point
- 230 · 230-232 °C(Solvent: Methanol)
- Boiling point
- 589.7 · 589.7±50.0 °C(Predicted)
- Density
- 1.321 · 1.321±0.06 g/cm3(Predicted)
- pka
- 12.62 · 12.62±0.70(Predicted)
Chemistry & industry
Suppliers15 total
上海凯森斯生物科技有限公司18616988519 · [email protected]
南京世洲生物科技有限公司025-025-85560043 17301488900 · [email protected]
上海赛可锐生物科技有限公司021-58000709 13120558703 · [email protected]
上海迈瑞尔生化科技有限公司4006356688 18621169109 · [email protected]
安耐吉化学&3A（安徽泽升科技股份有限公司）400-0056266 · [email protected]
上海维亦特生物科技有限公司15317051735 · [email protected]
湖南汇百侍生物科技有限公司0731-85526065 13308475853 · [email protected]
金瓯生物医药（南京）有限公司13000000000 · [email protected]
南京世洲生物科技有限公司13675144456 · [email protected]
BOC Sciences16314854226 · [email protected]
北京秦岭医药科技有限公司010-61241352 18901327973 · [email protected]
武汉峰耀同辉化学制品有限公司027-87466105 15377573527 · [email protected]
上海贝万塔生物科技有限公司021-67187366 19901745723 · [email protected]
Coresyn Pharmatech Co., Ltd.+86-571-86626709 +86-18157142896 · [email protected]
Related reactions
0 records
No reaction records under the current filter.
Compound notes
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