Details of the Drug

General Information of Drug (ID: DMML0QS)

Drug Name
Heparan sulfate
Synonyms Heparan sulfate (inflammation/neurodegeneration/angiogenesis/wound healing/cancer/cardiovascular disorders/infectious diseases)
Indication
Disease Entry ICD 11 Status REF
Angiogenesis disorder BE2Z Investigative [1]
Drug Type
Small molecular drug
Structure
3D MOL 2D MOL
Chemical Identifiers
Formula
C14H25NO21S3
Canonical SMILES
COC1C(C(C(OC1C(=O)O)OC2C(OC(C(C2O)NOS(=O)(=O)O)OC)COS(=O)(=O)O)OS(=O)(=O)O)O
InChI
InChI=1S/C14H25NO21S3/c1-29-9-7(17)10(35-38(23,24)25)14(34-11(9)12(18)19)33-8-4(3-31-37(20,21)22)32-13(30-2)5(6(8)16)15-36-39(26,27)28/h4-11,13-17H,3H2,1-2H3,(H,18,19)(H,20,21,22)(H,23,24,25)(H,26,27,28)/t4-,5-,6-,7+,8-,9+,10-,11-,13+,14+/m0/s1
InChIKey
AUQASCCBXZRMEG-RHKLHVFKSA-N
Cross-matching ID
PubChem CID
53477715
CAS Number
9050-30-0
TTD ID
D0A1QC

References

1 The ChEMBL database in 2017. Nucleic Acids Res. 2017 Jan 4;45(D1):D945-D954.