1616622-08-2 ((10R)-10,10'R-dioxybis[9,10-dihydro-3,8-dihydroxy-1,7,10-trimethyl-9-oxo-2-anthracenecarboxylicacid],(10R)-10-[(9R)-3-Carboxy-2,5-dihydroxy-4,6,9-trimethyl-10-oxoanthracen-9-yl]peroxy-3,8-dihydroxy-1,7,10-trimethyl-9-oxoanthracene-2-carboxylic acid)

CAS号:
1616622-08-2
中文名称:
(10R)-10,10'R-dioxybis[9,10-dihydro-3,8-dihydroxy-1,7,10-trimethyl-9-oxo-2-anthracenecarboxylicacid]
英文名称:
(10R)-10-[(9R)-3-Carboxy-2,5-dihydroxy-4,6,9-trimethyl-10-oxoanthracen-9-yl]peroxy-3,8-dihydroxy-1,7,10-trimethyl-9-oxoanthracene-2-carboxylic acid
分子式:
C36H30O12
分子量:
654.616211414337

(10R)-10,10'R-dioxybis[9,10-dihydro-3,8-dihydroxy-1,7,10-trimethyl-9-oxo-2-anthracenecarboxylicacid](1616622-08-2)名称与标识符

名称

英文别名:
(+)-Oxanthromicin;1;(10R)-10-[(9R)-3-Carboxy-2,5-dihydroxy-4,6,9-trimethyl-10-oxoanthracen-9-yl]peroxy-3,8-dihydroxy-1,7;Oxanthromicin, (+);CHEBI:200705;(10R)-10-{[(9R)-3-carboxy-2,5-dihydroxy-4,6,9-trimethyl-10-oxo-9,10-dihydroanthracen-9-yl]peroxy}-3,8-dihydroxy-1,7,10-trimethyl-9-oxo-9,10-dihydroanthracene-2-carboxylate;1616622-08-2;(10R)-10-((9R)-3-carboxy-2,5-dihydroxy-4,6,9-trimethyl-10-oxoanthracen-9-yl)peroxy-3,8-dihydroxy-1,7,10-trimethyl-9-oxoanthracene-2-carboxylic acid;2-Anthracenecarboxylic acid, 10,10'-dioxybis(9,10-dihydro-3,8-dihydroxy-1,7,10-trimethyl-9-oxo-, (R*,R*)-(-)-;(10R)-10,10'R-dioxybis[9,10-dihydro-3,8-dihydroxy-1,7,10-trimethyl-9-oxo-2-anthracenecarboxylicacid];DTXSID60920275;Oxanthromicin;10,10'-Peroxybis(3,8-dihydroxy-1,7,10-trimethyl-9-oxo-9,10-dihydroanthracene-2-carboxylic acid);(10R)-10-(((9R)-3-carboxy-2,5-dihydroxy-4,6,9-trimethyl-10-oxo-9,10-dihydroanthracen-9-yl)peroxy)-3,8-dihydroxy-1,7,10-trimethyl-9-oxo-9,10-dihydroanthracene-2-carboxylate;(10R)-10-[(9R)-3-carboxy-2,5-dihydroxy-4,6,9-trimethyl-10-oxoanthracen-9-yl]peroxy-3,8-dihydroxy-1,7,10-trimethyl-9-oxoanthracene-2-carboxylic acid;90614-51-0;

标识符

InChIKey:
IEVJARSTOGQGJT-ZPGRZCPFSA-N
Inchi:
1S/C36H30O12/c1-13-7-9-17-27(29(13)39)31(41)23-15(3)25(33(43)44)21(37)11-19(23)35(17,5)47-48-36(6)18-10-8-14(2)30(40)28(18)32(42)24-16(4)26(34(45)46)22(38)12-20(24)36/h7-12,37-40H,1-6H3,(H,43,44)(H,45,46)/t35-,36-/m0/s1
SMILES:
O([C@@]1(C)C2C=CC(C)=C(C=2C(C2C(C)=C(C(=O)O)C(=CC1=2)O)=O)O)O[C@@]1(C)C2C=CC(C)=C(C=2C(C2C(C)=C(C(=O)O)C(=CC1=2)O)=O)O

(10R)-10,10'R-dioxybis[9,10-dihydro-3,8-dihydroxy-1,7,10-trimethyl-9-oxo-2-anthracenecarboxylicacid](1616622-08-2)物化性质

计算特性

  • 精确分子量 : 654.17372639 g/mol
  • 氢键供体数量 : 6
  • 氢键受体数量 : 12
  • 可旋转化学键数量 : 5
  • 同位素质量 : 654.17372639 g/mol
  • 重原子数量 : 48
  • 复杂度 : 1220
  • 同位素原子数量 : 0
  • 确定原子立构中心数量 : 2
  • 不确定原子立构中心数量 : 0
  • 确定化学键立构中心数量 : 0
  • 不确定化学键立构中心数量 : 0
  • 共价键单元数量 : 1
  • 疏水参数计算参考值(XlogP) : 7.2
  • 拓扑分子极性表面积 : 208
  • 分子量 : 654.6

(10R)-10,10'R-dioxybis[9,10-dihydro-3,8-dihydroxy-1,7,10-trimethyl-9-oxo-2-anthracenecarboxylicacid](1616622-08-2)推荐厂家 更多厂家(2)

公司名称手机号/电话联系人QQ微信询单
上海瀚思化工有限公司 18939883912
021-34536277
顾经理 3003949364
询单
上海麦克林生化科技股份有限公司 15221275939
021-50706066
沈经理 269348414
询单

(10R)-10,10'R-dioxybis[9,10-dihydro-3,8-dihydroxy-1,7,10-trimethyl-9-oxo-2-anthracenecarboxylicacid](1616622-08-2)相关文献