Plumieride
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Plumieride
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CAS No:
511-89-7
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Formula:
C21H26O12
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Chemical Name:
Plumieride
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Synonyms:
Spiro[cyclopenta[c]pyran-7(1H),2′(5′H)-furan]-4-carboxylic acid,1-(β-D-glucopyranosyloxy)-4a,7a-dihydro-4′-[(1S)-1-hydroxyethyl]-5′-oxo-,methyl ester,(1S,2′R,4aS,7aS)-;Plumieride;Spiro[cyclopenta[c]pyran-7(1H),2′(5′H)-furan]-4-carboxylic acid,1-(β-D-glucopyranosyloxy)-4a,7a-dihydro-4′-(1-hydroxyethyl)-5′-oxo-,methyl ester,[1S-[1α,4aα,7α(R*),7aα]]-;Agoniadin;NSC 609065;101231-14-5;11024-61-6
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CAS No:
Characteristics
181
-4.23
1.6±0.1 g/cm3
224-225 °C
771.4±60.0 °C at 760 mmHg
269.2±26.4 °C
1.645
-20°C
D20 -114°; D20 -80° (methanol)
Computed Properties
Molecular Weight:470.4
XLogP3:-1.2
Hydrogen Bond Donor Count:5
Hydrogen Bond Acceptor Count:12
Rotatable Bond Count:6
Exact Mass:470.14242626
Monoisotopic Mass:470.14242626
Topological Polar Surface Area:181
Heavy Atom Count:33
Complexity:896
Defined Atom Stereocenter Count:10
Covalently-Bonded Unit Count:1
Compound Is Canonicalized:Yes
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