Carlucci_et_al_Sterylglucosides_activities_ChEMBL.tab
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https://dataverse.unr.edu.ar/file.xhtml?persistentId=doi:10.57715/UNR/CY7ICJ/VQ7EGE
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资源简介：
Each of the three structures was used as input to ChEMBL's advanced search engine (https://www.ebi.ac.uk/chembl/) “chemical search” -> “SIMILARITY>95%”.
SMILES:
*beta-sitosterylglucoside: CC[C@H](CC[C@@H](C)[C@H]1CC[C@H]2[C@@H]3CC=C4C[C@H](CC[C@]4(C)[C@H]3CC[C@]12C)O[C@@H]1O[C@H](CO)[C@@H](O)[C@H](O)[C@H]1O)C(C)C
*stigmasterylglucoside: CC[C@H](\C=C\[C@@H](C)[C@H]1CC[C@H]2[C@@H]3CC=C4C[C@H](CC[C@]4(C)[C@H]3CC[C@]12C)O[C@@H]1O[C@H](CO)[C@@H](O)[C@H](O)[C@H]1O)C(C)C
*campesterylglucoside:
CC(C)[C@H](C)CC[C@@H](C)[C@H]1CC[C@H]2[C@@H]3CC=C4C[C@H](CC[C@]4(C)[C@H]3CC[C@]12C)O[C@@H]1O[C@H](CO)[C@@H](O)[C@H](O)[C@H]1O
Three entries were obtained for beta-sitosterylglucoside, one for stigmasterylglucoside and none for campesterylglucoside. Each entry is presented as a separate sheet indicating the corresponding ChEMBL ID preceded by “B” for beta-sitosterylglucoside and “S” for stigmasterylglucoside.
提供机构：
RDA UNR
创建时间：
2025-05-22
