Raffinose | MolMeDB

Raffinose

2D Structure

3D Structure

Source:

General
Identifier	MM00301
SMILES	OC[C@H]1O[C@@](CO)(O[C@H]2O[C@H](CO[C@H]3O[C@H](CO)[C@H](O)[C@H](O)[C@H]3O)[C@@H](O)[C@H](O)[C@H]2O)[C@@H](O)[C@@H]1O Presented in the original dataset.
InChIKey	MUPFEKGTMRGPLJ-ZQSKZDJDSA-N Automatically obtained from RDkit software.
MW [Da]	504.44 Automatically obtained from RDkit software.
LogP	-7.57 Automatically obtained from RDkit software.

Links
PubChem	439242 Presented in the original dataset.
DrugBank	N/A
ChEBI	N/A
PDB	N/A
ChEMBL	N/A

Similar entries

Similarity: 0.9774

Similarity to Sucrose

Tanimoto metric	0.9774
Cosine metric	0.9886
Dice metric	0.9886

Total passive interactions

Raffinose	5
Sucrose	19

Total active interactions

Raffinose	0
Sucrose	0

No data

Methods

Computed

Q-based

QSAR

No data

No transporter data found.

Data downloader (...)

Chosen membranes (0)

Chosen methods (0)

Chosen molecules (0)