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(+)-Byakangelicin
SpectraBase Compound ID FXVLLHOmujX
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
InChIKey PKRPFNXROFUNDE-UHFFFAOYSA-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 1dxdlqjloUF
Name (+)-Byakangelicin
CAS Registry Number 88548-17-8
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
InChIKey PKRPFNXROFUNDE-UHFFFAOYSA-N
Molecular Weight 334.324 g/mol
SMILES OC(C(COc1c2c(c(OC)c3c1occ3)C=CC(O2)=O)O)(C)C
SPLASH splash10-0fsi-2190000000-e7763ff4553ffcae8338
Source of Spectrum W5-1989-38811-26725
Synonyms (R)-9-(2,3-Dihydroxy-3-methylbutoxy)-4-methoxy-7H-furo(3,2-g)(1)benzopyran-7-one 4-Methoxy-9-[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-(2,3-dihydroxy-3-methyl-butoxy)-4-methoxy-furo[3,2-g]chromen-7-one 9-(2,3-dihydroxy-3-methylbutoxy)-4-methoxy-7-furo[3,2-g][1]benzopyranone 9-(2,3-dihydroxy-3-methylbutoxy)-4-methoxy-7H-furo[3,2-g]chromen-7-one Biacangelicin Bjacangelicin Bjakangelicin Byakangelicin Byankagelicine
Wiley ID 1330809