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9-deoxygoniopypyrone

9-deoxygoniopypyrone structure

CAS No:
136685-37-5
Formula:
C13H14O4
Chemical Name:
9-deoxygoniopypyrone
Synonyms:
9-deoxygoniopypyrone;(7S)-3,7-Anhydro-2,4-dideoxy-7-C-phenyl-D-xyloheptonic acid Delta-lactone
Categories:
Natural Products > Phenols

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9-deoxygoniopypyrone Basic Attributes

Molecular Weight：

234.251

Exact Mass：

234.089

Characteristics

PSA：

55.8

XLogP3：

0.9

Drug Information

MeSH Entry Terms：

9-deoxygoniopypyrone

Computed Properties

Molecular Weight:234.25
XLogP3:0.9
Hydrogen Bond Donor Count:1
Hydrogen Bond Acceptor Count:4
Rotatable Bond Count:1
Exact Mass:234.08920892
Monoisotopic Mass:234.08920892
Topological Polar Surface Area:55.8
Heavy Atom Count:17
Complexity:298
Defined Atom Stereocenter Count:4
Covalently-Bonded Unit Count:1
Compound Is Canonicalized:Yes