19202-92-7 (细叶堆心菊素,2H-1,4-Dioxadicyclopent[cd,f]azulene-3,9-dione,2a,4a,5,6,6a,9a,9b,9c-octahydro-2-hydroxy-2,2a,6,9a-tetramethyl-)

CAS号:
19202-92-7
中文名称:
细叶堆心菊素
英文名称:
2H-1,4-Dioxadicyclopent[cd,f]azulene-3,9-dione,2a,4a,5,6,6a,9a,9b,9c-octahydro-2-hydroxy-2,2a,6,9a-tetramethyl-
分子式:
C17H22O5
分子量:
306.353585720062

细叶堆心菊素(19202-92-7)名称与标识符

名称

中文别名:
團菊素;细叶堆心菊素;
英文别名:
2H-1,4-Dioxadicyclopent[cd,f]azulene-3,9-dione,2a,4a,5,6,6a,9a,9b,9c-octahydro-2-hydroxy-2,2a,6,9a-tetramethyl-;2H-1,4-Dioxadicyclopent[cd,f]azulene-3,9-dione,2a,4a,5,6,6a,9a,9b,9c-octahydro-2-hydroxy-2,2a,...;(11R,13ξ)-6β,13-epoxy-8α,13-dihydroxy-11,13-dimethyl-4-oxo-ambros-2-en-12-oic acid-8-lactone;(11R,13ξ)-6β,13-Epoxy-8α,13-dihydroxy-11,13-dimethyl-4-oxo-ambros-2-en-12-saeure-8-lacton;2-hydroxy-2,2a,6,9a-tetramethyl-2a,4a,5,6,6a,9a,9b,9c-octahydro-2H-1,4-dioxadicyclopenta[cd,f]azulene-3,9-dione;AC1L3CF2;AC1Q6CR8;AGN-PC-0159UR;Ambros-2-en-12-oic acid, 6-β,13-epoxy-8-α,13-dihydroxy-11-methyl-4-oxo-;AR-1E1921;LS-16554;SureCN3343445;tenulin;Aids020844;Aids-020844;2H-1,4-Dioxadicyclopent[cd,F]azulene-3,9-dione, 2A,4A,5,6,6A,9A,9B,9C-octahydro-2-hydroxy-2,2A,6,9A-tetramethyl-;BDBM50250368;19202-92-7;Ambros-2-en-12-oic acid, 6.beta.,13-epoxy-8.alpha.,13-dihydroxy-11-methyl-4-oxo-, .gamma.-lactone;(2aR,4aS,6R,6aR,9aR,9bR,9cR)-2-hydroxy-2,2a,6,9a-tetramethyl-2a,4a,5,6,6a,9a,9b,9c-octahydro-2H-1,4-dioxadicyclopenta(cd,f)azulene-3,9-dione;NSC-19942;NSC 19942;Q27108396;CHEMBL490324;2H-1,f]azulene-3,9-dione, 2a,4a,5,6,6a,9a,9b,9c-octahydro-2-hydroxy-2,2a,6,9a-tetramethyl-, [2R-(2.alpha.,2a.alpha.,4a.alpha.,6.alpha.,6a.alpha.,9a.beta.,9b.alpha.,9c.alpha.)]-;UNII-8O6QE3MHR3;2H-1,4-Dioxadicyclopenta(cd,f)azulene-3,9-dione, 2a,4a,5,6,6a,9a,9b,9c-octahydro-2-hydroxy-2,2a,6,9a-tetramethyl-, (2aR,4aS,6R,6aR,9aR,9bR,9cR)-;(1R,2R,6R,7R,9S,12R,15R)-13-hydroxy-2,7,12,13-tetramethyl-10,14-dioxatetracyclo[7.5.1.02,6.012,15]pentadec-4-ene-3,11-dione;CS-0637568;DTXSID60971161;8O6QE3MHR3;(2AR,4aS,6R,6aR,9aR,9bR,9cR)-2-hydroxy-2,2a,6,9a-tetramethyl-2a,4a,5,6,6a,9a,9b,9c-octahydro-2H-1,4-dioxadicyclopenta[cd,f]azulene-3,9-dione;C09557;55780-22-8;Ambros-2-en-12-oic acid, 6-beta,13-epoxy-8-alpha,13-dihydroxy-11-methyl-4-oxo-, gamma-lactone;NSC19942;HY-N10919;2H-1,f]azulene-3,9-dione, 2a,4a,5,6,6a,9a,9b,9c-octahydro-2-hydroxy-2,2a,6,9a-tetramethyl-;NCI60_001654;CHEBI:9441;DTXSID90874954;AKOS040735463;SCHEMBL3343445;13-Hydroxy-2,7,12,13-tetramethyl-10,14-dioxatetracyclo[7.5.1.02,6.012,15]pentadec-4-ene-3,11-dione;

标识符

InChIKey:
CNIULSUYTFOEHN-MEBIVNBJSA-N
Inchi:
1S/C17H22O5/c1-8-7-10-12-13(15(2)9(8)5-6-11(15)18)22-17(4,20)16(12,3)14(19)21-10/h5-6,8-10,12-13,20H,7H2,1-4H3/t8-,9+,10+,12-,13-,15+,16+,17?/m1/s1
SMILES:
O1C(C)([C@]2(C)C(=O)O[C@H]3C[C@@H](C)[C@@H]4C=CC([C@@]4(C)[C@H]1[C@H]23)=O)O

细叶堆心菊素(19202-92-7)物化性质

实验特性

  • LogP : 1.05270
  • PSA : 72.83000
  • 折射率 : 1.6120 (estimate)
  • 沸点 : 366.97°C (rough estimate)
  • 熔点 : 197°C
  • 闪点 : 180.3°C
  • 颜色与性状 : Powder
  • 密度 : 1.1188 (rough estimate)

计算特性

  • 精确分子量 : 292.13100
  • 氢键供体数量 : 1
  • 氢键受体数量 : 5
  • 可旋转化学键数量 : 0
  • 同位素质量 : 306.147
  • 重原子数量 : 22
  • 复杂度 : 612
  • 同位素原子数量 : 0
  • 确定原子立构中心数量 : 0
  • 不确定原子立构中心数量 : 8
  • 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) : 0.3
  • 拓扑分子极性表面积 : 72.8A^2

细叶堆心菊素(19202-92-7)推荐厂家 更多厂家(3)

公司名称手机号/电话联系人QQ微信询单
武汉天植生物技术有限公司 18607107848张小姐 2056216494
询单
四川维克奇生物科技有限公司 13348961525杨洋 2851167780
询单
上海源叶生物科技有限公司 15026964105
15026964105
汤思磊 2881489226
询单

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