(2S)-2,3-Dihydro-2-[4-hydroxy-3-(3-methyl-2-buten-1-yl)phenyl]-8,8-dimethyl-4H,8H-benzo[1,2-b:3,4-b′]dipyran-4-one
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![(2S)-2,3-Dihydro-2-[4-hydroxy-3-(3-methyl-2-buten-1-yl)phenyl]-8,8-dimethyl-4H,8H-benzo[1,2-b:3,4-b′]dipyran-4-one structure](https://file.echemi.com/fileManage/upload/canonicalSmiles/20220811/6a0a4b51dbe345d59115d55bec40324b.png "(2S)-2,3-Dihydro-2-[4-hydroxy-3-(3-methyl-2-buten-1-yl)phenyl]-8,8-dimethyl-4H,8H-benzo[1,2-b:3,4-b′]dipyran-4-one")
(2S)-2,3-Dihydro-2-[4-hydroxy-3-(3-methyl-2-buten-1-yl)phenyl]-8,8-dimethyl-4H,8H-benzo[1,2-b:3,4-b′]dipyran-4-one
structure -
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CAS No:
157414-03-4
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Formula:
C25H26O4
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Chemical Name:
(2S)-2,3-Dihydro-2-[4-hydroxy-3-(3-methyl-2-buten-1-yl)phenyl]-8,8-dimethyl-4H,8H-benzo[1,2-b:3,4-b′]dipyran-4-one
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Synonyms:
4H,8H-Benzo[1,2-b:3,4-b′]dipyran-4-one,2,3-dihydro-2-[4-hydroxy-3-(3-methyl-2-buten-1-yl)phenyl]-8,8-dimethyl-,(2S)-;4H,8H-Benzo[1,2-b:3,4-b′]dipyran-4-one,2,3-dihydro-2-[4-hydroxy-3-(3-methyl-2-butenyl)phenyl]-8,8-dimethyl-,(S)-;4H,8H-Benzo[1,2-b:3,4-b′]dipyran-4-one,2,3-dihydro-2-[4-hydroxy-3-(3-methyl-2-butenyl)phenyl]-8,8-dimethyl-,(2S)-;(2S)-2,3-Dihydro-2-[4-hydroxy-3-(3-methyl-2-buten-1-yl)phenyl]-8,8-dimethyl-4H,8H-benzo[1,2-b:3,4-b′]dipyran-4-one;Shinflavanone
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CAS No:
(2S)-2,3-Dihydro-2-[4-hydroxy-3-(3-methyl-2-buten-1-yl)phenyl]-8,8-dimethyl-4H,8H-benzo[1,2-b:3,4-b′]dipyran-4-one Basic Attributes
390.5 g/mol
390.47
DTXSID80166259
(2S)-2,3-Dihydro-2-[4-hydroxy-3-(3-methyl-2-buten-1-yl)phenyl]-8,8-dimethyl-4H,8H-benzo[1,2-b:3,4-b′]dipyran-4-one Use and Manufacturing
Polyketides [PK] -> Flavonoids [PK12] -> Flavanones [PK1214]
Computed Properties
Molecular Weight:390.5
XLogP3:5.4
Hydrogen Bond Donor Count:1
Hydrogen Bond Acceptor Count:4
Rotatable Bond Count:3
Exact Mass:390.18310931
Monoisotopic Mass:390.18310931
Topological Polar Surface Area:55.8
Heavy Atom Count:29
Complexity:674
Defined Atom Stereocenter Count:1
Covalently-Bonded Unit Count:1
Compound Is Canonicalized:Yes
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