Name: Dde Biotin-PEG4-TAMRA-PEG4 Alkyne
Rating: 5 (10 reviews)

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HIT ID:HIT214314800
Cas No:2353409-55-7
常用名:Dde Biotin-PEG4-TAMRA-PEG4 Alkyne
常用名:Dde Biotin-PEG4-TAMRA-PEG4 Alkyne
IUPAC:9-(4-{[2-({2-[(1-{5-[(3aS,4S,6aR)-2-oxo-hexahydro-1H-thieno[3,4-d]imidazol-4-yl]pentanamido}-15-(4,4-dimethyl-2,6-dioxocyclohexylidene)-3,6,9,12-tetraoxa-16-azanonadecan-19-yl)carbamoyl]ethyl}(3,6,9,12-tetraoxapentadec-14-yn-1-yl)carbamoyl)ethyl]carbamoyl}-2-carboxyphenyl)-3-amino-6-(dimethylamino)-10lambda4-xanthen-10-ylium
IUPAC:9-(4-{[2-({2-[(1-{5-[(3aS,4S,6aR)-2-oxo-hexahydro-1H-thieno[3,4-d]imidazol-4-yl]pentanamido}-15-(4,4-dimethyl-2,6-dioxocyclohexylidene)-3,6,9,12-tetraoxa-16-azanonadecan-19-yl)carbamoyl]ethyl}(3,6,9,12-tetraoxapentadec-14-yn-1-yl)carbamoyl)ethyl]carbamoyl}-2-carboxyphenyl)-3-amino-6-(dimethylamino)-10lambda4-xanthen-10-ylium
InChI key:BKDLHWZLBYFNEX-FPUWCDOWSA-O

分子式:C72H100N9O18S
分子量:1411.7
氢键供体数 (HBD):
氢键受体数 (HBA):
LogP:
SMILES:[H][C@]12[#6]-[#16]-[#6@@H](-[#6]-[#6]-[#6]-[#6]-[#6](=O)-[#7]-[#6]-[#6]-[#8]-[#6]-[#6]-[#8]-[#6]-[#6]-[#8]-[#6]-[#6]-[#8]-[#6]-[#6]\[#6](-[#7]-[#6]-[#6]-[#6]-[#7]-[#6](=O)-[#6]-[#6]-[#7](-[#6]-[#6]-[#8]-[#6]-[#6]-[#8]-[#6]-[#6]-[#8]-[#6]-[#6]-[#8]-[#6]C#C)-[#6](=O)-[#6]-[#6]-[#7]-[#6](=O)-c3ccc(c(c3)-[#6](-[#8])=O)-c3c4ccc(-[#7])cc4[o+]c4cc(ccc34)-[#7](-[#6])-[#6])=[#6]-3\[#6](=O)-[#6]C([#6])([#6])[#6]-[#6]-3=O)[C@@]1([H])[#7]-[#6](=O)-[#7]2
SMILES:[H][C@]12[#6]-[#16]-[#6@@H](-[#6]-[#6]-[#6]-[#6]-[#6](=O)-[#7]-[#6]-[#6]-[#8]-[#6]-[#6]-[#8]-[#6]-[#6]-[#8]-[#6]-[#6]-[#8]-[#6]-[#6]\[#6](-[#7]-[#6]-[#6]-[#6]-[#7]-[#6](=O)-[#6]-[#6]-[#7](-[#6]-[#6]-[#8]-[#6]-[#6]-[#8]-[#6]-[#6]-[#8]-[#6]-[#6]-[#8]-[#6]C#C)-[#6](=O)-[#6]-[#6]-[#7]-[#6](=O)-c3ccc(c(c3)-[#6](-[#8])=O)-c3c4ccc(-[#7])cc4[o+]c4cc(ccc34)-[#7](-[#6])-[#6])=[#6]-3\[#6](=O)-[#6]C([#6])([#6])[#6]-[#6]-3=O)[C@@]1([H])[#7]-[#6](=O)-[#7]2

Dde Biotin-PEG4-TAMRA-PEG4 Alkyne, a PEG-based PROTAC linker, facilitates PROTAC synthesis[1].

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