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3'-angeloyloxy-4'-acetoxy-3',4'-dihydroseselin

3'-angeloyloxy-4'-acetoxy-3',4'-dihydroseselin structure

CAS No:
81740-05-8
Formula:
C21H22O7
Chemical Name:
3'-angeloyloxy-4'-acetoxy-3',4'-dihydroseselin
Synonyms:
(9alpha(Z),10alpha)-(+-) of 3"-angeloyloxy-4"-acetoxy-3",4"-dihydroseselin;3"-angeloyloxy-4"-acetoxy-3",4"-dihydroseselin;9alpha(E),10alpha of 3"-angeloyloxy-4"-acetoxy-3",4"-dihydroseselin;9alpha(E),10beta of 3"-angeloyloxy-4"-acetoxy-3",4"-dihydroseselin;9R-(9alpha(Z),10alpha) of 3"-angeloyloxy-4"-acetoxy-3",4"-dihydroseselin;9S-(9alpha(Z),10alpha) of 3"-angeloyloxy-4"-acetoxy-3",4"-dihydroseselin;Pd-Ia;Praeruptorin A;73069-25-7

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3'-angeloyloxy-4'-acetoxy-3',4'-dihydroseselin Basic Attributes

Molecular Weight：

386.39518

Exact Mass：

386.136553

Characteristics

PSA：

88.1

Drug Information

MeSH Entry Terms：

(9alpha(Z),10alpha)-(+-) of 3'-angeloyloxy-4'-acetoxy-3',4'-dihydroseselin|praeruptorin A

Computed Properties

Molecular Weight:386.4
XLogP3:3.1
Hydrogen Bond Acceptor Count:7
Rotatable Bond Count:5
Exact Mass:386.13655304
Monoisotopic Mass:386.13655304
Topological Polar Surface Area:88.1
Heavy Atom Count:28
Complexity:720
Undefined Atom Stereocenter Count:2
Defined Bond Stereocenter Count:1
Covalently-Bonded Unit Count:1
Compound Is Canonicalized:Yes

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Guide of 3'-angeloyloxy-4'-acetoxy-3',4'-dihydroseselin

Basic Attributes
Characteristics
Drug Information
Computed Properties

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