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

*Links on SpectraBase are not permalinks.
sodium [3-[[(8aS)-2,5,5,8a-tetramethyl-1,4,4a,6,7,8-hexahydronaphthalen-1-yl]methyl]-2,4,5-trihydroxyphenyl] sulfate
SpectraBase Compound ID 2LrI6mzPVhc
InChI InChI=1S/C21H30O7S.Na/c1-12-6-7-17-20(2,3)8-5-9-21(17,4)14(12)10-13-18(23)15(22)11-16(19(13)24)28-29(25,26)27;/h6,11,14,17,22-24H,5,7-10H2,1-4H3,(H,25,26,27);/q;+1/p-1/t14?,17?,21-;/m1./s1
InChIKey DBGGQVSZBSPTBA-BTPWFVFRSA-M
Mol Weight 448.51 g/mol
Molecular Formula C21H29NaO7S
Exact Mass 448.153169 g/mol
Parent InChIKey FSCNWLOPXBALPS-KDDGLUCOSA-M
Enantiomer InChIKey DBGGQVSZBSPTBA-CJGCWGEJSA-M
Unknown Identification

Search your unknown spectrum against the world's largest collection of reference spectra

KnowItAll Campus Solutions

KnowItAll offers faculty and students at your school access to all the tools you need for spectral analysis and structure drawing & publishing! Plus, access the world's largest spectral library.