首页/数据集/Compound 527258: 1,9-Decadiene, 4-methyl

Compound 527258: 1,9-Decadiene, 4-methyl

Name: Compound 527258: 1,9-Decadiene, 4-methyl
Creator: U.S. Department of Health & Human Services
Published: 2025-12-20T08:41:04+08:00

data.gov2025-12-20 收录

化学信息学

理化性质分析

数据链接：

https://catalog.data.gov/dataset/compound-527258-19-decadiene-4-methyl 数据链接链接失效反馈

官方服务：

资源简介：

Chemical compound data from PubChem database. IUPAC Name: 4-methyldeca-1,9-diene. Molecular Formula: C11H20. Molecular Weight: 152.28. This dataset contains...

应用场景：

提供机构：

U.S. Department of Health & Human Services

化学信息学

分子特性分析

This is a physical chemical entity[CHEBI_24431] associated with a molecule[CHEBI_25367]. The molecule[CHEBI_25367] can be described by the following structural desciptors[cheminf_000085]: InChI desc

DataCite Commons2025-03-16 更新40

A Cheminformatic analysis of Secondary Metabolites in Jordanian Medicinal Plants and Their Potential Therapeutic Applications.

天然药物发现

化学信息学

Jordan harbors a rich diversity of medicinal plants with a long history of ethnopharmacological use. However, comprehensive cheminformatic analyses of their secondary metabolites remain limited. We ai

Zenodo2025-05-21 更新00

A Machine Learning Approach for Predicting Defluorination of Per- and Polyfluoroalkyl Substances (PFAS) for Their Efficient Treatment and Removal

PFAS脱氟预测

化学信息学

We present the first application of machine learning on per- and polyfluoroalkyl substances (PFAS) for predicting and rationalizing carbon–fluorine (C–F) bond dissociation energies to aid in their eff

Figshare2019-09-09 更新00

GDBChEMBL sub set dictionnary of CNOFS molecules with SMILES and sillywalk score

药物相似性

化学信息学

The 3 786 315 neutral singlet molecules without any atomic charges (formal or real) composed of only H, C, N, O, F and S that belong to GDBChEMBL. Data only proposed for the reproducibility of th

Figshare2023-02-28 更新00

List of 552 Mycotoxins and associated Smiles and JOELib descriptors

化学信息学

真菌毒素风险评估

Mycotoxin list containing 552 compounds was created from a literature search. From the compound names, simplified molecular-input line-entry system (Smiles) data were automatically retrieved using the

Zenodo2022-02-05 更新00

Compound 527258: 1,9-Decadiene, 4-methyl

资源简介：

相关数据集