(S,E)-3-((E)-2-((1R,3AS,7aR)-1-((R)-6-Hydroxy-6-methylheptan-2-yl)-7a-methylhexahydro-1H-inden-4(2H)-ylidene)ethylidene)-4-methylenecyclohexanol(CAS番号:36149-00-5)

基本情報

(S,E)-3-((E)-2-((1R,3AS,7aR)-1-((R)-6-Hydroxy-6-methylheptan-2-yl)-7a-methylhexahydro-1H-inden-4(2H)-ylidene)ethylidene)-4-methylenecyclohexanol

CAS番号

36149-00-5

分子式

C27H44O2

分子量

400.65 g/mol

Quick Actions

基本的な物理特性

SMILES

O[C@@H]1C/C(C(CC1)=C)=C\C=C2[C@]3([H])CC[C@H]([C@@H](CCCC(C)(O)C)C)[C@@]3(C)CCC\2

InChI

InChI=1S/C27H44O2/c1-19-10-13-23(28)18-22(19)12-11-21-9-7-17-27(5)24(14-15-25(21)27)20(2)8-6-16-26(3,4)29/h11-12,20,23-25,28-29H,1,6-10,13-18H2,2-5H3/b21-11+,22-12+

InChIKey

JWUBBDSIWDLEOM-XHQRYOPUSA-N

LogP

6.733900000000008

トポロジカル極性表面積

40.46 Ų

水素結合ドナー/アクセプター

2 / 2

分類と用途

安全情報

安全情報を表示

同義語と参考文献

英語

  • 9,10-Secocholesta-5,7,10(19)-triene-3,25-diol,(3b,5E,7E)- (9CI)
  • (3E)-3-[(2Z)-2-[1-(6-hydroxy-6-methylheptan-2-yl)-7a-methyl-2,3,3a,5,6,7-hexahydro-1H-inden-4-ylidene]ethylidene]-4-methylidenecyclohexan-1-ol
  • 25-Hydroxy-5,6-trans-cholecalciferol
  • 3-{2-[1-(5-HYDROXY-1,5-DIMETHYL-HEXYL)-7A-METHYL-OCTAHYDRO-INDEN-4-YLIDENE]-ETHYLIDENE}-4-METHYLENE-CYCLOHEXANOL
  • (3beta,5E,7E)-9,10-Secocholesta-5,7,10(19)-triene-3,25-diol
  • (5E,7Z)-9,10-secocholesta-5,7,10-triene-3,25-diol
  • 25-Hydroxy-5,6-trans-vitamin D3
  • 5,6-trans-25-Hydroxycholecalciferol
  • 5,6-trans-25-Hydroxyvitamin D3
  • 9,10-Secocholesta-5,7,10(19)-triene-3,25-diol, (3beta,5E,7E)-

MDL_Number

MFCD30534331

CAS番号

36149-00-5

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2019-10-28 Paper

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2018-04-16 Communication

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Enhanced activity of catalysts on substrates with surface protonic current in an electrical field – a review

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2021-05-19 Feature Article

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2019-10-08 Communication

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Ultra-thin NiFeSe nanosheets as a highly efficient bifunctional electrocatalyst for overall water splitting

Yu-Yang Sun, Mei-Yan Jiang, Guang-Ya Hou, Yi-Ping Tang, Min Liu

2019-11-20 Paper

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Biomimetic hydrogels designed for cartilage tissue engineering

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2021-02-12 Review Article

DOI: 10.1039/D0BM01852J