(8S-顺式)-10-((3-氨基-2,3-二脱氧-alpha-L-核-己糖吡喃糖苷)氧基)-7,8,9,10-四氢-6,8,11-三羟基-8-(羟基乙酰基)-1-甲氧基-5,12-并四苯醌
[CAS# 62414-01-1]

基本信息

• 产品名称: (8S-顺式)-10-((3-氨基-2,3-二脱氧-alpha-L-核-己糖吡喃糖苷)氧基)-7,8,9,10-四氢-6,8,11-三羟基-8-(羟基乙酰基)-1-甲氧基-5,12-并四苯醌
• 英文名: (8S-cis)-10-((3-Amino-2,3-Dideoxy-alpha-L-Ribo-Hexopyranosyl)Oxy)-7,8,9,10-Tetrahydro-6,8,11-Trihydroxy-8-(Hydroxyacetyl)-1-Methoxy-5,12-Naphthacenedione
• 别名: 7-[4-Amino-5-Hydroxy-6-(Hydroxymethyl)Tetrahydropyran-2-Yl]Oxy-6,9,11-Trihydroxy-9-(2-Hydroxyacetyl)-4-Methoxy-8,10-Dihydro-7H-Tetracene-5,12-Dione; 7-[[4-Amino-5-Hydroxy-6-(Hydroxymethyl)-2-Tetrahydropyranyl]Oxy]-6,9,11-Trihydroxy-9-(2-Hydroxy-1-Oxoethyl)-4-Methoxy-8,10-Dihydro-7H-Tetracene-5,12-Dione; 7-(4-Amino-5-Hydroxy-6-Methylol-Tetrahydropyran-2-Yl)Oxy-9-Glycoloyl-6,9,11-Trihydroxy-4-Methoxy-8,10-Dihydro-7H-Tetracene-5,12-Quinone
• 分子式: C₂₇H₂₉NO₁₂
• 分子量: 559.53
• CAS 登录号: 62414-01-1 (58928-62-4)
• 分子行输入简码 SMILES: C5=C4C(=O)C1=C(C(=C2C(=C1O)CC(O)(CC2OC3OC(C(O)C(N)C3)CO)C(=O)CO)O)C(=O)C4=C(OC)C=C5
• 国际化学标识码 InChI: 1S/C27H29NO12/c1-38-13-4-2-3-10-18(13)25(35)21-20(22(10)32)23(33)11-6-27(37,16(31)9-30)7-14(19(11)26(21)36)39-17-5-12(28)24(34)15(8-29)40-17/h2-4,12,14-15,17,24,29-30,33-34,36-37H,5-9,28H2,1H3
• 国际化学标识检索码 InChIKey: MMNLCGHZNCRLMM-UHFFFAOYSA-N

物理化学性质

• 密度: 1.676g/cm³ （计算值）
• 沸点: 857.122°C at 760 mmHg （计算值）
• 闪点: 472.171°C （计算值）