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Byak-angelicin
SpectraBase Compound ID JT7ioyZQlkX
InChI InChI=1S/C17H18O7/c1-17(2,20)11(18)8-23-16-14-10(6-7-22-14)13(21-3)9-4-5-12(19)24-15(9)16/h4-7,11,18,20H,8H2,1-3H3/t11-/m1/s1
InChIKey PKRPFNXROFUNDE-LLVKDONJSA-N
Mol Weight 334.32 g/mol
Molecular Formula C17H18O7
Exact Mass 334.105253 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID 9o09dSEBA3P
Name Byak-angelicin
CAS Registry Number 482-25-7
Copyright Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved.
Formula C17H18O7
InChI InChI=1S/C17H18O7/c1-17(2,20)11(18)8-23-16-14-10(6-7-22-14)13(21-3)9-4-5-12(19)24-15(9)16/h4-7,11,18,20H,8H2,1-3H3/t11-/m1/s1
InChIKey PKRPFNXROFUNDE-LLVKDONJSA-N
Molecular Weight 334.324 g/mol
SMILES OC([C@@](COc1c2c(c(OC)c3c1occ3)C=CC(O2)=O)(O)[H])(C)C
SPLASH splash10-00lr-3091000000-81c01539ec6274fc86c9
Source of Spectrum CD-364-0-0
Synonyms (+)-Byakangelicin (R)-9-(2,3-Dihydroxy-3-methylbutoxy)-4-methoxy-7H-furo(3,2-g)(1)benzopyran-7-one 4-Methoxy-9-[(2R)-3-methyl-2,3-bis(oxidanyl)butoxy]furo[3,2-g]chromen-7-one 7H-Furo(3,2-g)(1)benzopyran-7-one, 9-(2,3-dihydroxy-3-methylbutoxy)-4-methoxy-, (R)- 9-[(2R)-2,3-dihydroxy-3-methyl-butoxy]-4-methoxy-furo[3,2-g]chromen-7-one 9-[(2R)-2,3-dihydroxy-3-methylbutoxy]-4-methoxy-7-furo[3,2-g][1]benzopyranone 9-{[(2R)-2,3-dihydroxy-3-methylbutyl]oxy}-4-methoxy-7H-furo[3,2-g]chromen-7-one Biacangelicin Bjacangelicin Bjakangelicin Byankagelicine
Wiley ID 1330808