Name: Dabcyl-YVADAPV-EDANS
Rating: 5 (10 reviews)

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HIT ID:HIT212721692
Cas No:161877-70-9
常用名:Dabcyl-YVADAPV-EDANS
IUPAC:(3S)-3-[(2S)-2-[(2S)-2-[(2S)-2-[(4-{2-[4-(dimethylamino)phenyl]diazen-1-yl}phenyl)formamido]-3-(4-hydroxyphenyl)propanamido]-3-methylbutanamido]propanamido]-3-{[(2S)-1-[(2S)-2-{[(1S)-2-methyl-1-({2-[(5-sulfonaphthalen-1-yl)amino]ethyl}carbamoyl)propyl]carbamoyl}pyrrolidin-1-yl]-1-oxopropan-2-yl]carbamoyl}propanoic acid
IUPAC:(3S)-3-[(2S)-2-[(2S)-2-[(2S)-2-[(4-{2-[4-(dimethylamino)phenyl]diazen-1-yl}phenyl)formamido]-3-(4-hydroxyphenyl)propanamido]-3-methylbutanamido]propanamido]-3-{[(2S)-1-[(2S)-2-{[(1S)-2-methyl-1-({2-[(5-sulfonaphthalen-1-yl)amino]ethyl}carbamoyl)propyl]carbamoyl}pyrrolidin-1-yl]-1-oxopropan-2-yl]carbamoyl}propanoic acid
InChI key:VOOSFUAACNZZDI-BSNYRHCXSA-N

分子式:C61H76N12O14S
分子量:1233.41
氢键供体数 (HBD):11
氢键受体数 (HBA):18
LogP:2.7585735
SMILES:CC(C)[C@H](NC(=O)[C@H](Cc1ccc(O)cc1)NC(=O)c1ccc(cc1)N=Nc1ccc(cc1)N(C)C)C(=O)N[C@@H](C)C(=O)N[C@@H](CC(O)=O)C(=O)N[C@@H](C)C(=O)N1CCC[C@H]1C(=O)N[C@@H](C(C)C)C(=O)NCCNc1cccc2c(cccc12)S(O)(=O)=O |w:25.26|
SMILES:CC(C)[C@H](NC(=O)[C@H](Cc1ccc(O)cc1)NC(=O)c1ccc(cc1)N=Nc1ccc(cc1)N(C)C)C(=O)N[C@@H](C)C(=O)N[C@@H](CC(O)=O)C(=O)N[C@@H](C)C(=O)N1CCC[C@H]1C(=O)N[C@@H](C(C)C)C(=O)NCCNc1cccc2c(cccc12)S(O)(=O)=O |w:25.26|

Dabcyl YVADAPV EDANS 是一种荧光 IL-1β 转化酶 (interleukin-1β converting enzyme, ICE) 底物，可用于检测 ICE 样蛋白酶活性。Dabcyl YVADAPV EDANS 检测荧光的 λex=360 nm，λem=480 nm。

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