 Home > Encyclopedia > 2-(4-hydroxyphenyl)-7-methoxy-5-[(2S,3R,4S,5S,6R)-3,4,5-trihydroxy-6-[[(2S,3R,4S,5R)-3,4,5-trihydroxyoxan-2-yl]oxymethyl]oxan-2-yl]oxychromen-4-one

2-(4-hydroxyphenyl)-7-methoxy-5-[(2S,3R,4S,5S,6R)-3,4,5-trihydroxy-6-[[(2S,3R,4S,5R)-3,4,5-trihydroxyoxan-2-yl]oxymethyl]oxan-2-yl]oxychromen-4-one

2-(4-hydroxyphenyl)-7-methoxy-5-[(2S,3R,4S,5S,6R)-3,4,5-trihydroxy-6-[[(2S,3R,4S,5R)-3,4,5-trihydroxyoxan-2-yl]oxymethyl]oxan-2-yl]oxychromen-4-one structure

CAS No:
77099-20-8
Formula:
C27H30O14
Chemical Name:
2-(4-hydroxyphenyl)-7-methoxy-5-[(2S,3R,4S,5S,6R)-3,4,5-trihydroxy-6-[[(2S,3R,4S,5R)-3,4,5-trihydroxyoxan-2-yl]oxymethyl]oxan-2-yl]oxychromen-4-one
Synonyms:
Yuankanin;77099-20-8;4H-1-Benzopyran-4-one, 2-(4-hydroxyphenyl)-7-methoxy-5-((6-O-beta-D-xylopyranosyl-beta-D-glucopyranosyl)oxy)-;CHEMBL3121247;DTXSID90227880;2-(4-Hydroxyphenyl)-7-methoxy-5-[(6-O-|A-D-xylopyranosyl-|A-D-glucopyranosyl)oxy]-4H-1-benzopyran-4-one;4H-1-Benzopyran-4-one,2-(4-hydroxyphenyl)-7-methoxy-5-[(6-O-b-D-xylopyranosyl-b-D-glucopyranosyl)oxy]-
Categories:
Pharmaceutical Intermediates > Bulk Drug Intermediates

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2-(4-hydroxyphenyl)-7-methoxy-5-[(2S,3R,4S,5S,6R)-3,4,5-trihydroxy-6-[[(2S,3R,4S,5R)-3,4,5-trihydroxyoxan-2-yl]oxymethyl]oxan-2-yl]oxychromen-4-one Basic Attributes

Molecular Weight：

578.5 g/mol

Exact Mass：

578.16355563 g/mol

DSSTox ID：

DTXSID90227880

Characteristics

PSA：

214 Å²

Computed Properties

Molecular Weight:578.5
XLogP3:-1.4
Hydrogen Bond Donor Count:7
Hydrogen Bond Acceptor Count:14
Rotatable Bond Count:7
Exact Mass:578.16355563
Monoisotopic Mass:578.16355563
Topological Polar Surface Area:214
Heavy Atom Count:41
Complexity:924
Defined Atom Stereocenter Count:9
Covalently-Bonded Unit Count:1
Compound Is Canonicalized:Yes

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Guide of 2-(4-hydroxyphenyl)-7-methoxy-5-[(2S,3R,4S,5S,6R)-3,4,5-trihydroxy-6-[[(2S,3R,4S,5R)-3,4,5-trihydroxyoxan-2-yl]oxymethyl]oxan-2-yl]oxychromen-4-one

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