For citations & permissions, please see: Citations & Permissions - Wiley Science Solutions*

*Links on SpectraBase are not permalinks.
Costinone A [(E)-Methyl 2-[2-oxo-1-(2",3",5"-trihydroxyphenyl)-1,2-dihydro-3H-indol-3-ylidene]acetate]
SpectraBase Compound ID AfdluBxT4g6
InChI InChI=1S/C17H13NO6/c1-24-15(21)8-11-10-4-2-3-5-12(10)18(17(11)23)13-6-9(19)7-14(20)16(13)22/h2-8,19-20,22H,1H3/b11-8-
InChIKey RSQKQBWNKRMGCZ-FLIBITNWSA-N
Mol Weight 327.29 g/mol
Molecular Formula C17H13NO6
Exact Mass 327.074287 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

View the Full Spectrum for FREE!

The full spectrum can only be viewed using a FREE account.

SpectraBase Spectrum ID FXLtT4Pdxft
Name Costinone A [(E)-Methyl 2-[2-oxo-1-(2",3",5"-trihydroxyphenyl)-1,2-dihydro-3H-indol-3-ylidene]acetate]
Copyright Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved.
Formula C17H13NO6
InChI InChI=1S/C17H13NO6/c1-24-15(21)8-11-10-4-2-3-5-12(10)18(17(11)23)13-6-9(19)7-14(20)16(13)22/h2-8,19-20,22H,1H3/b11-8-
InChIKey RSQKQBWNKRMGCZ-FLIBITNWSA-N
Molecular Weight 327.292 g/mol
SMILES Oc1cc(cc(c1O)N1C(\C(=C/C(=O)OC)c2c1cccc2)=O)O
SPLASH splash10-00ou-9451000000-24fec5881b9f24cf441c
Source of Spectrum H1-65-1426-1
Synonyms (2Z)-2-[2-oxo-1-(2,3,5-trihydroxyphenyl)-3-indolylidene]acetic acid methyl ester Methyl (2Z)-2-[2-oxo-1-(2,3,5-trihydroxyphenyl)indol-3-ylidene]acetate Methyl (2Z)-2-[2-oxo-1-(2,3,5-trihydroxyphenyl)indolin-3-ylidene]acetate Methyl (2Z)-2-[2-oxidanylidene-1-[2,3,5-tris(oxidanyl)phenyl]indol-3-ylidene]ethanoate
Wiley ID 1593593