MSI_000055918

Unavailable

排名分数: -0.35
参考来源: Homo sapiens (UBERON:0007779: transudate)

M/z: 694.3958
Mass Window: 694.3958 ~ 694.3958 (none)

参考注释

Eribulin_[M+H-2H2O]+ (BioDeep_00000178787)
20-(3-Amino-2-hydroxypropyl)-21-methoxy-14-methyl-8,15-dimethylidene-2,19,30,34,37,39,40,41-octaoxanonacyclo[24.9.2.1~3,32~.1~3,33~.1~6,9~.1~12,16~.0~18,22~.0~29,36~.0~31,35~]hentetracontan-24-one (non-preferred name)

Formula: C40H59NO11 (729.4087904)
SMILES: CC1CC2CCC3C(=C)CC(O3)CCC45CC6C(O4)C7C(O6)C(O5)C8C(O7)CCC(O8)CC(=O)CC9C(CC(C1=C)O2)OC(C9OC)CC(CN)O