Deacetylgedunin
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Deacetylgedunin
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CAS No:
10314-90-6
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Formula:
C26H32O6
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Chemical Name:
Deacetylgedunin
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Synonyms:
Oxireno[c]phenanthro[1,2-d]pyran-3,8(3aH,4bH)-dione,1-(3-furanyl)-1,5,6,6a,7,10a,10b,11,12,12a-decahydro-5-hydroxy-4b,7,7,10a,12a-pentamethyl-,(1S,3aS,4aR,4bS,5R,6aR,10aR,10bR,12aS)-;16,17-Seco-24-nor-5α,13α,14β,17α-chola-1,20,22-trien-16-oic acid,14,15β:21,23-diepoxy-7α,17-dihydroxy-4,4,8-trimethyl-3-oxo-,16,17-lactone;D-Homo-24-nor-17-oxachola-1,20,22-triene-3,16-dione,14,15:21,23-diepoxy-7-hydroxy-4,4,8-trimethyl-,(5α,7α,13α,14β,15β,17aα)-;Gedunin,7-deacetyl-;(1S,3aS,4aR,4bS,5R,6aR,10aR,10bR,12aS)-1-(3-Furanyl)-1,5,6,6a,7,10a,10b,11,12,12a-decahydro-5-hydroxy-4b,7,7,10a,12a-pentamethyloxireno[c]phenanthro[1,2-d]pyran-3,8(3aH,4bH)-dione;7-Deacetoxy-7-hydroxygedunin;Deacetylgedunin;7-Deacetylgedunin;NSC 309912;7-Deacetoxy-7α-hydroxygedunin;7-Deacetilgedunin;7-Deacetoxy-7α-hydroxyoxygedunin;101509-56-2
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CAS No:
Description
ChEBI: A limonoid that is the 7-deacetyl derivative of gedunin. It has been isolated from Azadirachta indica.
Computed Properties
Molecular Weight:440.5
XLogP3:3.6
Hydrogen Bond Donor Count:1
Hydrogen Bond Acceptor Count:6
Rotatable Bond Count:1
Exact Mass:440.21988874
Monoisotopic Mass:440.21988874
Topological Polar Surface Area:89.3
Heavy Atom Count:32
Complexity:925
Undefined Atom Stereocenter Count:9
Covalently-Bonded Unit Count:1
Compound Is Canonicalized:Yes