BMMCBZ2Ok003
From Metabolomics.JP
(Redirected from INCHI:IWYDHOAUDWTVEP-ZETCQYMHSA-N)
Basic Metabolism Top (代謝トップ) |
Molecule Index (化合物索引) |
EC classes ( EC分類) |
Input New Data (新規入力) |
Upper classes : BM Basic Metabolites : BMMC mono- or assembled cycle 単、複合環 : BMMCBZ benzene ring ベンゼン環 : BMMCBZ2O 2 substitutions (ortho) (38 pages)
IDs and Links | |
---|---|
LipidBank | [1] |
LipidMaps | [2] |
CAS | 17199-29-0 |
KEGG | C01984 |
KNApSAcK | |
CDX file | |
MOL file | BMMCBZ2Ok003.mol |
(S) -Mandelate | |
---|---|
Structural Information | |
Systematic Name | (S) -2-Hydroxy-2-phenyl-acetic acid |
Common Name |
|
Symbol | |
Formula | C8H8O3 |
Exact Mass | 152.0473 |
Average Mass | 152.1473 |
SMILES | OC(=O)[C@@H](O)c(c1)cccc1 |
Physicochemical Information | |
Melting Point | |
Boiling Point | |
Density | |
Optical Rotation | |
Reflactive Index | |
Solubility | |
Spectral Information | |
Mass Spectra | |
UV Spectra | |
IR Spectra | |
NMR Spectra | |
Chromatograms |
Related Atomic Mappings, Enzymes, and Pathways