 Home > Encyclopedia > 2-[(3S,4S,5S,6R)-7-Hydroxy-4,6-diMethoxy-3,5-diMethylheptyl]-5,7-diMethoxy-8-(MethoxyMethoxy)-3-Methyl-2,3-dihydro-4H-1-benzopyran-4-one

2-[(3S,4S,5S,6R)-7-Hydroxy-4,6-diMethoxy-3,5-diMethylheptyl]-5,7-diMethoxy-8-(MethoxyMethoxy)-3-Methyl-2,3-dihydro-4H-1-benzopyran-4-one

2-[(3S,4S,5S,6R)-7-Hydroxy-4,6-diMethoxy-3,5-diMethylheptyl]-5,7-diMethoxy-8-(MethoxyMethoxy)-3-Methyl-2,3-dihydro-4H-1-benzopyran-4-one structure

CAS No:
276690-22-3
Formula:
C25H38O9
Chemical Name:
2-[(3S,4S,5S,6R)-7-Hydroxy-4,6-diMethoxy-3,5-diMethylheptyl]-5,7-diMethoxy-8-(MethoxyMethoxy)-3-Methyl-2,3-dihydro-4H-1-benzopyran-4-one
Synonyms:
2-[(3S,4S,5S,6R)-7-Hydroxy-4,6-diMethoxy-3,5-diMethylheptyl]-5,7-diMethoxy-8-(MethoxyMethoxy)-3-Methyl-2,3-dihydro-4H-1-benzopyran-4-one;YUAHLBULSCMHCH-VVWDJELWSA-N;4H-1-Benzopyran-4-one, 2-[(3S,4S,5S,6R)-7-hydroxy-4,6-dimethoxy-3,5-dimethylheptyl]-5,7-dimethoxy-8-(methoxymethoxy)-3-methyl-

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2-[(3S,4S,5S,6R)-7-Hydroxy-4,6-diMethoxy-3,5-diMethylheptyl]-5,7-diMethoxy-8-(MethoxyMethoxy)-3-Methyl-2,3-dihydro-4H-1-benzopyran-4-one Basic Attributes

Molecular Weight：

482.56

Exact Mass：

484.26723285

Characteristics

PSA：

105.82000

XLogP3：

3.32840

Density：

1.133±0.06 g/cm3

Boiling Point：

595.3±50.0 °C(Predicted)

PKA：

14.31±0.10

2-[(3S,4S,5S,6R)-7-Hydroxy-4,6-diMethoxy-3,5-diMethylheptyl]-5,7-diMethoxy-8-(MethoxyMethoxy)-3-Methyl-2,3-dihydro-4H-1-benzopyran-4-one Use and Manufacturing

2-[(3S,4S,5S,6R)-7-Hydroxy-4,6-dimethoxy-3,5-dimethylheptyl]-5,7-dimethoxy-8-(methoxymethoxy)-3-methyl-4H-1-benzopyran-4-one is an intermediate in the preparation of Stigmatellin A (S686780).

Computed Properties

Molecular Weight:484.6
XLogP3:3.3
Hydrogen Bond Donor Count:1
Hydrogen Bond Acceptor Count:9
Rotatable Bond Count:14
Exact Mass:484.26723285
Monoisotopic Mass:484.26723285
Topological Polar Surface Area:102
Heavy Atom Count:34
Complexity:603
Defined Atom Stereocenter Count:4
Undefined Atom Stereocenter Count:2
Covalently-Bonded Unit Count:1
Compound Is Canonicalized:Yes

Hot Searches: aluminum carbonate; flunarizine; sodium hypobromite; nitrous oxide formula; fluoroethylene carbonate; carbonyl sulfide

Guide of 2-[(3S,4S,5S,6R)-7-Hydroxy-4,6-diMethoxy-3,5-diMethylheptyl]-5,7-diMethoxy-8-(MethoxyMethoxy)-3-Methyl-2,3-dihydro-4H-1-benzopyran-4-one

Basic Attributes
Characteristics
Use and Manufacturing
Computed Properties

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