PHOSPHATIDYLCHOLINE

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

Structure
InChI Key ZZWQHNRGJQENEP-KXQOOQHDSA-N
Smile CCCCCCCCCCCCCCSCC(=O)OC[C@H](COP(=O)([O-])OCC[N+](C)(C)C)OC(=O)CSCCCCCCCCCCCCCC
InChI
InChI=1S/C40H80NO8PS2/c1-6-8-10-12-14-16-18-20-22-24-26-28-32-51-36-39(42)46-34-38(35-48-50(44,45)47-31-30-41(3,4)5)49-40(43)37-52-33-29-27-25-23-21-19-17-15-13-11-9-7-2/h38H,6-37H2,1-5H3/t38-/m1/s1

Physicochemical Descriptors

Property Name Value
Molecular Formula C40H80NO8PS2
Molecular Weight 798.19
AlogP 10.52
Hydrogen Bond Acceptor 10.0
Hydrogen Bond Donor 0.0
Number of Rotational Bond 40.0
Polar Surface Area 111.19
Molecular species ACID
Aromatic Rings 0.0
Heavy Atoms 52.0

Indications

Mesh Heading Maximum Phase Mesh ID Reference
Hepatitis, Autoimmune 3 D019693 ClinicalTrials
Wounds and Injuries 2 D014947 ClinicalTrials
Colitis, Ulcerative 2 D003093 ClinicalTrials
Schizophrenia 1 D012559 ClinicalTrials

Cross References

Resources Reference
ChEMBL CHEMBL503481
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