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MTC 智能计算中心MTC Computing Center AI × 蛋白质与酶工程AI for Protein & Enzyme Engineering

化合物信息

名称 内容
kegg编号 C16143
pubchemid 47205453
name (1E,4S,5E,7R)-Germacra-1(10),5-dien-11-ol
formula C15H26O
structure
Isomeric_Smiles CC1=C(C=C(C=C1)NC(=O)CN2CCS(=O)(=O)CC2)C
Cannoical_Smiles CC1=C(C=C(C=C1)NC(=O)CN2CCS(=O)(=O)CC2)C
Gotenzyme_Smiles C/C1=C\CC[C@H](C)/C=C/[C@H](C(C)(C)O)CC1