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rel-3-[12-[(2R,3S)-3-[(3E)-3-Hexadecen-1-yl]-2-oxiranyl]dodecyl]-5-methyl-2(5H)-furanone

rel-3-[12-[(2R,3S)-3-[(3E)-3-Hexadecen-1-yl]-2-oxiranyl]dodecyl]-5-methyl-2(5H)-furanone structure

CAS No:
151484-64-9
Formula:
C35H62O3
Chemical Name:
rel-3-[12-[(2R,3S)-3-[(3E)-3-Hexadecen-1-yl]-2-oxiranyl]dodecyl]-5-methyl-2(5H)-furanone
Synonyms:
2(5H)-Furanone,3-[12-[(2R,3S)-3-[(3E)-3-hexadecen-1-yl]-2-oxiranyl]dodecyl]-5-methyl-,rel-;2(5H)-Furanone,3-[12-[3-(3-hexadecenyl)oxiranyl]dodecyl]-5-methyl-;rel-3-[12-[(2R,3S)-3-[(3E)-3-Hexadecen-1-yl]-2-oxiranyl]dodecyl]-5-methyl-2(5H)-furanone;Epoxymurin A;Epomuricenin A;150670-81-8

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Description

Epoxymurin-A is a polyketide.

rel-3-[12-[(2R,3S)-3-[(3E)-3-Hexadecen-1-yl]-2-oxiranyl]dodecyl]-5-methyl-2(5H)-furanone Basic Attributes

Molecular Weight：

530.9 g/mol

Exact Mass：

530.86

DSSTox ID：

DTXSID20415076

Characteristics

PSA：

38.8 Å²

Water Solubility：

3.915e-009 mg/L @ 25 °C (est)

Computed Properties

Molecular Weight:530.9
XLogP3:13.8
Hydrogen Bond Acceptor Count:3
Rotatable Bond Count:27
Exact Mass:530.46989584
Monoisotopic Mass:530.46989584
Topological Polar Surface Area:38.8
Heavy Atom Count:38
Complexity:637
Undefined Atom Stereocenter Count:3
Defined Bond Stereocenter Count:1
Covalently-Bonded Unit Count:1
Compound Is Canonicalized:Yes

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Guide of rel-3-[12-[(2R,3S)-3-[(3E)-3-Hexadecen-1-yl]-2-oxiranyl]dodecyl]-5-methyl-2(5H)-furanone

Description
Basic Attributes
Characteristics
Computed Properties

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