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2-(1,7-dihydroxytetradeca-4,12-dien-8,10-diyn-6-yloxy)-6-(hydroxymethyl)oxane-3,4,5-triol

2-(1,7-dihydroxytetradeca-4,12-dien-8,10-diyn-6-yloxy)-6-(hydroxymethyl)oxane-3,4,5-triol structure

CAS No:
129277-38-9
Formula:
C20H28O8
Chemical Name:
2-(1,7-dihydroxytetradeca-4,12-dien-8,10-diyn-6-yloxy)-6-(hydroxymethyl)oxane-3,4,5-triol
Synonyms:
isolobetyol;lobetyolin;Lobetyolin;2-(1,7-dihydroxytetradeca-4,12-dien-8,10-diyn-6-yloxy)-6-(hydroxymethyl)oxane-3,4,5-triol;DB-050292;(2R,3R,4S,5S,6R)-2-(((4E,12E)-1,7-Dihydroxytetradeca-4,12-dien-8,10-diyn-6-yl)oxy)-6-(hydroxymethyl)tetrahydro-2H-pyran-3,4,5-triol

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2-(1,7-dihydroxytetradeca-4,12-dien-8,10-diyn-6-yloxy)-6-(hydroxymethyl)oxane-3,4,5-triol Basic Attributes

Molecular Weight：

396.4 g/mol

Exact Mass：

396.17841785 g/mol

UNII：

YJZ71TRO1X

Characteristics

PSA：

140 Å²

XLogP3：

-1.556

Computed Properties

Molecular Weight:396.4
XLogP3:-0.6
Hydrogen Bond Donor Count:6
Hydrogen Bond Acceptor Count:8
Rotatable Bond Count:9
Exact Mass:396.17841785
Monoisotopic Mass:396.17841785
Topological Polar Surface Area:140
Heavy Atom Count:28
Complexity:646
Defined Atom Stereocenter Count:7
Defined Bond Stereocenter Count:2
Covalently-Bonded Unit Count:1
Compound Is Canonicalized:Yes

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Guide of 2-(1,7-dihydroxytetradeca-4,12-dien-8,10-diyn-6-yloxy)-6-(hydroxymethyl)oxane-3,4,5-triol

Basic Attributes
Characteristics
Computed Properties

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