EcoDrugPlus


Keyword(s):	Human Metabolites
Molecule Category	Free-form
UNII	1VN9P25L8H
EPA CompTox	DTXSID90224778

Keyword(s):

Human Metabolites

Molecule Category

Free-form

UNII

1VN9P25L8H

EPA CompTox

DTXSID90224778


InChI Key	FZMJEGJVKFTGMU-UHFFFAOYSA-N
Smiles	O(CC)[Si](OCC)(OCC)CCCCCCCCCCCCCCCCCC
InChI	InChI=1/C24H52O3Si/c1-5-9-10-11-12-13-14-15-16-17-18-19-20-21-22-23-24-28(25-6-2,26-7-3)27-8-4/h5-24H2,1-4H3

InChI Key

FZMJEGJVKFTGMU-UHFFFAOYSA-N

Smiles

O(CC)[Si](OCC)(OCC)CCCCCCCCCCCCCCCCCC

InChI

InChI=1/C24H52O3Si/c1-5-9-10-11-12-13-14-15-16-17-18-19-20-21-22-23-24-28(25-6-2,26-7-3)27-8-4/h5-24H2,1-4H3

Property Name	Value
Molecular Formula	C24H52O3Si
Molecular Weight	416.37
AlogP	8.3
Hydrogen Bond Acceptor	3.0
Number of Rotational Bond	23.0
Polar Surface Area	27.69
Heavy Atoms	28.0

Property Name

Value

Molecular Formula

C24H52O3Si

Molecular Weight

416.37

AlogP

8.3

Hydrogen Bond Acceptor

3.0

Number of Rotational Bond

23.0

Polar Surface Area

27.69

Heavy Atoms

28.0

Resources	Reference
CAS NUMBER	7399-00-0
NORMAN SUSDAT
FDA SRS	1VN9P25L8H
PubChem	81885

Resources

Reference

CAS NUMBER

7399-00-0

NORMAN SUSDAT

FDA SRS

1VN9P25L8H

PubChem

81885

EcoDrug+ was developed under the PREMIER 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 EcoDrug+ contains.

Elements of EcoDrug+ were developed under the Biocenter Finland Drug Discovery and Chemical Biology network. CSC-IT Center for Science Ltd is thanked for providing computational resources. Credit is given to Ensembl for collecting species images (provided under public domain licences such as Wikimedia and NHGRI).

Content of EcoDrug+ is provided without guarantee for correctness.

Cite Us:

Ashenafi Legehar, Siobhán Monaghan, Mael Briand, Akseli Niemelä, Leo Ghemtio, Ziaurrehman Tanoli, A Ross Brown, Charles R Tyler, Henri Xhaard, EcoDrug PLUS: an advanced database for drug target conservation analysis and environmental risk assessment, Nucleic Acids Research, 2025, gkaf1251 Read...

This work is licensed under Creative Commons Attribution-ShareAlike 4.0 International License

Last update: Monday, 3 November 2025

TRIETHOXYOCTADECYLSILANE

Structure

Physicochemical Descriptors

Cross References