1,4-Dihydroxy-5,8-bis[2-(2-hydroxypropylamino)ethylamino]anthracene-9,10-dione

HCID 433060

基本情報

CAS
70788-93-1
標準SMILES
CC(O)CNCCNc1ccc(NCCNCC(C)O)c2c1C(=O)c1c(O)ccc(O)c1C2=O
InChIKey
JUYSBXZDJLEGDD-UHFFFAOYSA-N
分子式
C24H32N4O6
平均分子量
472.5 g/mol
単同位体質量
472.23218474

名称と識別子

優先名称
1,4-Dihydroxy-5,8-bis[2-(2-hydroxypropylamino)ethylamino]anthracene-9,10-dione
IUPAC
1,4-dihydroxy-5,8-bis[2-(2-hydroxypropylamino)ethylamino]anthracene-9,10-dione

名称と別名

70788-93-11,4-Dihydroxy-5,8-bis((2-((2-hydroxypropyl)amino)ethyl)amino)anthracene-9,10-dione1,4-Dihydroxy-5,8-bis({2-[(2-hydroxypropyl)amino]ethyl}amino)anthracene-9,10-dioneNSC3217971,4-dihydroxy-5,8-bis[2-(2-hydroxypropylamino)ethylamino]anthracene-9,10-dioneCHEMBL3302750SCHEMBL10522772DTXSID90330843JUYSBXZDJLEGDD-UHFFFAOYSA-NNSC-3217975,8-dihydroxy-1,4-bis[2-(2-hydroxypropylamino)ethylamino]anthracene-9,10-dioneDS-005622
名称をさらに表示
1,4-bis[2-(2- hydroxypropylamino)ethylamino]-5,8-dihydroxyanthraquinone1,4-bis[2-(2-hydroxypropylamino)-ethylamino]-5,8-dihydroxyanthraquinone1,4-bis[2-(2-hydroxypropylamino)ethylamino]-5,8-dihydroxyanthraquinone1,4-dihydroxy-5,8-bis-[2-(2-hydroxypropylamino)ethylamino]anthraquinone1,4-dihydroxy-5,8-bis[2-(2-hydroxypropylamino)ethylamino]-anthraquinone9, 1,4-dihydroxy-5,8-bis[[2-[(2-hydroxypropyl)amino]ethyl]amino]-1,4-dihydroxy-5,8- bis[[2-[(2-hydroxypropyl)amino]ethyl]amino]-anthraquinone1,4-dihydroxy-5,8-bis[[2-[(2-hydroxypropyl)amino]ethyl]amino]-anthraquinone

データベース識別子

CAS
70788-93-1
PubChem CID
433060
DTXSID
DTXSID90330843
ChEMBL
CHEMBL3302750

物性

構造計算による物性

XLogP
1.9
極性表面積
163 Ų
水素結合供与体数
8
水素結合受容体数
10
回転可能結合数
12
重原子数
34

関連反応

22 件

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