Catalog Number:
AG01B2K2
Chemical Name:
sodium 4-(3,4,5-trihydroxybenzoyloxy)butanoate
CAS Number:
1955553-67-9
Molecular Formula:
C11H11NaO7
Molecular Weight:
278.1906
MDL Number:
MFCD29991644
IUPAC Name:
sodium;4-(3,4,5-trihydroxybenzoyl)oxybutanoate
InChI:
InChI=1S/C11H12O7.Na/c12-7-4-6(5-8(13)10(7)16)11(17)18-3-1-2-9(14)15;/h4-5,12-13,16H,1-3H2,(H,14,15);/q;+1/p-1
InChI Key:
LDLJWCJRAKPSMI-UHFFFAOYSA-M
SMILES:
O=C(c1cc(O)c(c(c1)O)O)OCCCC(=O)[O-].[Na+]
