TRANSCROCETINATE SODIUM

Search structure
Synonyms:
TSC
Status: Phase 3
Entry Type: Small molecule
Molecule Category: UNKNOWN
UNII: YP57637WMX

Structure
InChI Key RMDMBHQVNHQDDD-VFWKRBOSSA-L
Smile CC(/C=C/C=C(\C)C(=O)[O-])=C\C=C\C=C(C)\C=C\C=C(/C)C(=O)[O-].[Na+].[Na+]
InChI
InChI=1S/C20H24O4.2Na/c1-15(11-7-13-17(3)19(21)22)9-5-6-10-16(2)12-8-14-18(4)20(23)24;;/h5-14H,1-4H3,(H,21,22)(H,23,24);;/q;2*+1/p-2/b6-5+,11-7+,12-8+,15-9+,16-10+,17-13+,18-14+;;

Physicochemical Descriptors

Property Name Value
Molecular Formula C20H22Na2O4
Molecular Weight 372.37
AlogP 4.61
Hydrogen Bond Acceptor 2.0
Hydrogen Bond Donor 2.0
Number of Rotational Bond 8.0
Polar Surface Area 74.6
Molecular species ACID
Aromatic Rings 0.0
Heavy Atoms 24.0

Indications

Mesh Heading Maximum Phase Mesh ID Reference
Glioblastoma 3 D005909 ClinicalTrials
Lung Diseases, Interstitial 2 D017563 ClinicalTrials
Severe Acute Respiratory Syndrome 1 D045169 ClinicalTrials
Hypoxia 1 D000860 ClinicalTrials

Cross References

Resources Reference
ChEMBL CHEMBL3137335
FDA SRS YP57637WMX
PubChem 10287099
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