(2S)-2-[2,2-dimethyl-8-(3-methylbut-2-enyl)chromen-6-yl]-5,7-dihydroxy-2,3-dihydrochromen-4-one
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![(2S)-2-[2,2-dimethyl-8-(3-methylbut-2-enyl)chromen-6-yl]-5,7-dihydroxy-2,3-dihydrochromen-4-one structure](https://file.echemi.com/fileManage/upload/canonicalSmiles/20220811/e4867a0ed1ad4ba2a042389d1212e529.png "(2S)-2-[2,2-dimethyl-8-(3-methylbut-2-enyl)chromen-6-yl]-5,7-dihydroxy-2,3-dihydrochromen-4-one")
(2S)-2-[2,2-dimethyl-8-(3-methylbut-2-enyl)chromen-6-yl]-5,7-dihydroxy-2,3-dihydrochromen-4-one
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CAS No:
116174-67-5
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Formula:
C25H26O5
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Chemical Name:
(2S)-2-[2,2-dimethyl-8-(3-methylbut-2-enyl)chromen-6-yl]-5,7-dihydroxy-2,3-dihydrochromen-4-one
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Synonyms:
sigmoidin E;sigmoidin-E;Sigmoidin E;CHEMBL470655;116174-67-5;Sigmoidin-E;DTXSID50921953;BDBM50241819;(2,6'-Bi-2H-1-benzopyran)-4(3H)-one, 5,7-dihydroxy-2',2'-dimethyl-8'-(3-methyl-2-butenyl)-, (S)-;5,7-Dihydroxy-2',2'-dimethyl-8'-(3-methylbut-2-en-1-yl)-2,3-dihydro-2'H,4H-[2,6'-bi-1-benzopyran]-4-one
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CAS No:
(2S)-2-[2,2-dimethyl-8-(3-methylbut-2-enyl)chromen-6-yl]-5,7-dihydroxy-2,3-dihydrochromen-4-one Basic Attributes
406.5 g/mol
406.17802393 g/mol
Computed Properties
Molecular Weight:406.5
XLogP3:5.6
Hydrogen Bond Donor Count:2
Hydrogen Bond Acceptor Count:5
Rotatable Bond Count:3
Exact Mass:406.17802393
Monoisotopic Mass:406.17802393
Topological Polar Surface Area:76
Heavy Atom Count:30
Complexity:706
Defined Atom Stereocenter Count:1
Covalently-Bonded Unit Count:1
Compound Is Canonicalized:Yes
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