The Biofilms Structural Database
|
|
The Biofilms Structural Database |
Catechol 61445-50-9 |
|
|---|---|
6YOH |
|
Code
P4H | |
|
Name |
[2,4-bis(oxidanyl)phenyl]-[3,4-bis(oxidanyl)phenyl]methanone |
|
Molecular Weight |
246.22 |
|
Isomeric SMILES |
c1cc(c(cc1C(=O)c2ccc(cc2O)O)O)O |
|
Formula |
C13H10O5 |
|
Identifiers |
[2,4-bis(oxidanyl)phenyl]-[3,4-bis(oxidanyl)phenyl]methanone |
|
Formal Charge |
0 |
|
InChI |
InChI=1S/C13H10O5/c14-8-2-3-9(11(16)6-8)13(18)7-1-4-10(15)12(17)5-7/h1-6,14-17H |
|
Atom Count |
28 |
|
InChIKey |
UQQYIAVMUUJWGX-UHFFFAOYSA-N |
|
PDB codes |
6YOH |
|
Type |
NON-POLYMER |
|
Chiral Atom Count |
0 |
|
Chiral Atoms |
n/a |
|
Bond Count |
29 |
|
Aromatic Bond Count |
12 |
|
Leaving Atoms |
n/a |