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Deoxyelephantopin

Deoxyelephantopin structure

CAS No:
29307-03-7
Formula:
C19H20O6
Chemical Name:
Deoxyelephantopin
Synonyms:
2-Propenoic acid,2-methyl-,(3aR,4S,9R,11E,12aR)-2,3,3a,4,5,9,10,12a-octahydro-11-methyl-3-methylene-2,7-dioxo-7H-9,6-methenofuro[2,3-f]oxacycloundecin-4-yl ester;Germacra-1(10),4,11(13)-triene-12,14-dioic acid,2β,6α,8α-trihydroxy-,12,6:14,2-dilactone,methacrylate,(E)-;2-Propenoic acid,2-methyl-,2,3,3a,4,5,9,10,12a-octahydro-11-methyl-3-methylene-2,7-dioxo-7H-9,6-methenofuro[2,3-f]oxacycloundecin-4-yl ester,[3aR-(3aR*,4S*,9R*,11E,12aR*)]-;Methacrylic acid,8-ester with 2β,6α,8α-trihydroxygermacra-1(10),4,11(13)-triene-12,14-dioic acid di-γ-lactone,(E)-;7H-9,6-Methenofuro[2,3-f]oxacycloundecin,2-propenoic acid deriv.;Elephantopin,deoxy-;Deoxyelephantopin;NSC 259726;11-Methyl-3-methylene-2,7-dioxo-3,3a,4,5,7,9,10,12a-octahydro-2H-6,9-(metheno)furo[2,3-f][1]oxacycloundecin-4-yl methacrylate
Categories:
Natural Products > Terpenes

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Description

Isodeoxyelephantopin is a terpene lactone.

Deoxyelephantopin Basic Attributes

Molecular Weight：

344.4 g/mol

Exact Mass：

344.36

Characteristics

PSA：

78.90000

XLogP3：

1.51

Density：

1.3±0.1 g/cm3

Melting Point：

198-200 °C

Boiling Point：

584.3±50.0 °C at 760 mmHg

Flash Point：

258.1±30.2 °C

Refractive Index：

1.556

Drug Information

MeSH Entry Terms：

deoxyelephantopin

Computed Properties

Molecular Weight:344.4
XLogP3:2.4
Hydrogen Bond Acceptor Count:6
Rotatable Bond Count:3
Exact Mass:344.12598835
Monoisotopic Mass:344.12598835
Topological Polar Surface Area:78.9
Heavy Atom Count:25
Complexity:741
Undefined Atom Stereocenter Count:4
Undefined Bond Stereocenter Count:1
Covalently-Bonded Unit Count:1
Compound Is Canonicalized:Yes

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CAS No.: 29307-03-7

Grade: Pharmaceutical grade

Content: 99%

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Guide of Deoxyelephantopin

Description
Basic Attributes
Characteristics
Drug Information
Computed Properties
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Deoxyelephantopin

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