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Sorgolactone

Sorgolactone structure

CAS No:
141262-39-7
Formula:
C18H20O5
Chemical Name:
Sorgolactone
Synonyms:
2H-Indeno[1,2-b]furan-2-one,3-[[[(2R)-2,5-dihydro-4-methyl-5-oxo-2-furanyl]oxy]methylene]-3,3a,4,5,6,7,8,8b-octahydro-8-methyl-,(3E,3aR,8S,8bS)-;2H-Indeno[1,2-b]furan-2-one,3-[[(2,5-dihydro-4-methyl-5-oxo-2-furanyl)oxy]methylene]-3,3a,4,5,6,7,8,8b-octahydro-8-methyl-,[3aR-[3E(R*),3aα,8α,8bα]]-;(3E,3aR,8S,8bS)-3-[[[(2R)-2,5-Dihydro-4-methyl-5-oxo-2-furanyl]oxy]methylene]-3,3a,4,5,6,7,8,8b-octahydro-8-methyl-2H-indeno[1,2-b]furan-2-one;Sorgolactone;(+)-Sorgolactone
Categories:
Organic Chemistry > Lactones

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Description

Sorgolactone is a strigolactone and an indenofuran.

Sorgolactone Basic Attributes

Molecular Weight：

316.34800

Exact Mass：

316.35

UNII：

RH6QJZ6G3B

DSSTox ID：

DTXSID80415113

Characteristics

PSA：

61.83000

XLogP3：

2.77800

Density：

1.29g/cm3

Boiling Point：

600.6ºC at 760mmHg

Flash Point：

267.3ºC

Refractive Index：

1.581

Vapor Pressure：

2.2E-14mmHg at 25°C

Drug Information

MeSH Entry Terms：

sorgolactone

Computed Properties

Molecular Weight:316.3
XLogP3:2.2
Hydrogen Bond Acceptor Count:5
Rotatable Bond Count:2
Exact Mass:316.13107373
Monoisotopic Mass:316.13107373
Topological Polar Surface Area:61.8
Heavy Atom Count:23
Complexity:669
Defined Atom Stereocenter Count:4
Defined Bond Stereocenter Count:1
Covalently-Bonded Unit Count:1
Compound Is Canonicalized:Yes