Hispaglabridin A
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Hispaglabridin A
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CAS No:
68978-03-0
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Formula:
C25H28O4
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Chemical Name:
Hispaglabridin A
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Synonyms:
1,3-Benzenediol,4-[(3R)-3,4-dihydro-8,8-dimethyl-2H,8H-benzo[1,2-b:3,4-b′]dipyran-3-yl]-2-(3-methyl-2-buten-1-yl)-;1,3-Benzenediol,4-(3,4-dihydro-8,8-dimethyl-2H,8H-benzo[1,2-b:3,4-b′]dipyran-3-yl)-2-(3-methyl-2-butenyl)-,(R)-;1,3-Benzenediol,4-[(3R)-3,4-dihydro-8,8-dimethyl-2H,8H-benzo[1,2-b:3,4-b′]dipyran-3-yl]-2-(3-methyl-2-butenyl)-;2H,8H-Benzo[1,2-b:3,4-b′]dipyran,1,3-benzenediol deriv.;4-[(3R)-3,4-Dihydro-8,8-dimethyl-2H,8H-benzo[1,2-b:3,4-b′]dipyran-3-yl]-2-(3-methyl-2-buten-1-yl)-1,3-benzenediol;Hispaglabridin A
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CAS No:
Description
Hispaglabridin A is a member of the class of hydroxyisoflavans that is (R)-isoflavan substituted by hydroxy groups at positions 2' and 4' , a 3-methylbut-2-en-1-yl group at position 3' and a 2,2-dimethyl-2H-pyran group across positions 7 and 8 respectively. It has a role as a plant metabolite. It derives from a hydride of a (R)-isoflavan.
Computed Properties
Molecular Weight:392.5
XLogP3:5.8
Hydrogen Bond Donor Count:2
Hydrogen Bond Acceptor Count:4
Rotatable Bond Count:3
Exact Mass:392.19875937
Monoisotopic Mass:392.19875937
Topological Polar Surface Area:58.9
Heavy Atom Count:29
Complexity:635
Defined Atom Stereocenter Count:1
Covalently-Bonded Unit Count:1
Compound Is Canonicalized:Yes
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