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(-)-Praeruptorin A

(-)-Praeruptorin A structure

CAS No:
14017-71-1
Formula:
C21H22O7
Chemical Name:
(-)-Praeruptorin A
Synonyms:
Isopteryxin;Peupraerin I
Categories:
Natural Products > Coumarin and Derivatives

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(-)-Praeruptorin A Basic Attributes

Molecular Weight：

386.4

Exact Mass：

386.136566

DSSTox ID：

DTXSID20653395

Characteristics

PSA：

88.1

XLogP3：

4.18

Density：

1.3±0.1 g/cm3

Boiling Point：

486.8±45.0 °C at 760 mmHg

Flash Point：

211.5±28.8 °C

Refractive Index：

1.574

Drug Information

MeSH Entry Terms：

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

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
Defined Atom Stereocenter Count:2
Defined Bond Stereocenter Count:1
Covalently-Bonded Unit Count:1
Compound Is Canonicalized:Yes

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Guide of (-)-Praeruptorin A

Basic Attributes
Characteristics
Drug Information
Computed Properties
Learn More Other Chemicals

(-)-Praeruptorin A

SDS

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