EcoDrugPlus


Synonyms	E322 Lecithin Phospholipids egg
Status
Molecule Category	UNKNOWN

Synonyms

E322

Lecithin

Phospholipids egg

Status

Molecule Category

UNKNOWN


Active Pharmaceutical Ingredients Bioactive chemicals	Exact Similarity SubStructure	Threshold (%) >= 70


InChI Key	RBAWEGYJSDPEHX-UHFFFAOYSA-N
Smiles	C[N+](C)(C)CCOP(=O)([O-])OCC(COC=O)OC=O
InChI	InChI=1S/C10H20NO8P/c1-11(2,3)4-5-18-20(14,15)19-7-10(17-9-13)6-16-8-12/h8-10H,4-7H2,1-3H3

InChI Key

RBAWEGYJSDPEHX-UHFFFAOYSA-N

Smiles

C[N+](C)(C)CCOP(=O)([O-])OCC(COC=O)OC=O

InChI

InChI=1S/C10H20NO8P/c1-11(2,3)4-5-18-20(14,15)19-7-10(17-9-13)6-16-8-12/h8-10H,4-7H2,1-3H3

Property Name	Value
Molecular Formula	C10H20NO8P
Molecular Weight	313.24
AlogP	-1.09
Hydrogen Bond Acceptor	8.0
Hydrogen Bond Donor	0.0
Number of Rotational Bond	12.0
Polar Surface Area	111.19
Molecular species	ACID
Aromatic Rings	0.0
Heavy Atoms	20.0

Property Name

Value

Molecular Formula

C10H20NO8P

Molecular Weight

313.24

AlogP

-1.09

Hydrogen Bond Acceptor

8.0

Hydrogen Bond Donor

0.0

Number of Rotational Bond

12.0

Polar Surface Area

111.19

Molecular species

ACID

Aromatic Rings

0.0

Heavy Atoms

20.0

Resources	Reference
ChEMBL	CHEMBL2107798

Resources

Reference

ChEMBL

CHEMBL2107798


PREMIER has received funding from the Innovative Medicines Initiative 2 Joint Undertaking (JU) under grant agreement No 875508. The JU receives support from the EU’s Horizon 2020 research and innovation programme and the European Federation of Pharmaceutical Industries and Associations (EFPIA). The views reflect only the authors’ perspective and the JU is not responsible for any use that may be made of the information this manuscript contains. Elements of the website have been developed under projects PREMIER and the Biocenter Finland Drug Discovery and Chemical Biology network. CSC-IT is thanked for providing computational resources. Content of the website is provided without guarantee for correctness. Data has been collected and integrated from multiple public sources, for the largest: FDA, HUGO Gene Nomenclature Committee, ChEMBL, IUPHAR/BPS guide to pharmacology, Reactome, UniProt, and Ensembl. Credit is given to Ensembl for collecting species images (provided under public domain licences such as Wikimedia and NHGRI).

PREMIER has received funding from the Innovative Medicines Initiative 2 Joint Undertaking (JU) under grant agreement No 875508. The JU receives support from the EU’s Horizon 2020 research and innovation programme and the European Federation of Pharmaceutical Industries and Associations (EFPIA). The views reflect only the authors’ perspective and the JU is not responsible for any use that may be made of the information this manuscript contains.

Elements of the website have been developed under projects PREMIER and the Biocenter Finland Drug Discovery and Chemical Biology network. CSC-IT is thanked for providing computational resources. Content of the website is provided without guarantee for correctness. Data has been collected and integrated from multiple public sources, for the largest: FDA, HUGO Gene Nomenclature Committee, ChEMBL, IUPHAR/BPS guide to pharmacology, Reactome, UniProt, and Ensembl. Credit is given to Ensembl for collecting species images (provided under public domain licences such as Wikimedia and NHGRI).

LECITHIN

Structure

Physicochemical Descriptors

Related Entries

Cross References