ATTO 488 NHS ester
HIT218847494
sdf文件结构编辑类似物检索
HIT ID: HIT218847494
Cas No: 863772-22-9
分子式: C29H26N4O12S2
分子量: 686.66
常用名: ATTO 488 NHS ester
氢键受体数 (HBA):
氢键供体数 (HBD):
LogP:
IUPAC: 3,6-diamino-9-[2-({4-[(2,5-dioxopyrrolidin-1-yl)oxy]-4-oxobutyl}(methyl)carbamoyl)phenyl]-5-sulfo-10lambda4-xanthen-10-ylium-4-sulfonate
IUPAC: 3,6-diamino-9-[2-({4-[(2,5-dioxopyrrolidin-1-yl)oxy]-4-oxobutyl}(methyl)carbamoyl)phenyl]-5-sulfo-10lambda4-xanthen-10-ylium-4-sulfonate
SMILES: CN(CCCC(=O)ON1C(=O)CCC1=O)C(=O)c1ccccc1-c1c2ccc(N)c(c2[o+]c2c(c(N)ccc12)S([O-])(=O)=O)S(O)(=O)=O
SMILES: CN(CCCC(=O)ON1C(=O)CCC1=O)C(=O)c1ccccc1-c1c2ccc(N)c(c2[o+]c2c(c(N)ccc12)S([O-])(=O)=O)S(O)(=O)=O
InChI key: ANJMIDMYQHHNTO-UHFFFAOYSA-N
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