23554-81-6 (兔唇花灵,Spiro[furan-2(3H),1'(2'H)-naphthalene]-5,5'-dimethanol,decahydro-6'-hydroxy-5-(2-hydroxyethyl)-2',5',8'a-trimethyl-,(1'R,2'R,4'aS,5S,5'R,6'S,8'aS)-)

CAS号:
23554-81-6
中文名称:
兔唇花灵
英文名称:
Spiro[furan-2(3H),1'(2'H)-naphthalene]-5,5'-dimethanol,decahydro-6'-hydroxy-5-(2-hydroxyethyl)-2',5',8'a-trimethyl-,(1'R,2'R,4'aS,5S,5'R,6'S,8'aS)-
分子式:
C20H36O5
分子量:
356.49684715271

兔唇花灵(23554-81-6)名称与标识符

名称

中文别名:
兔唇花灵;
英文别名:
Spiro[furan-2(3H),1'(2'H)-naphthalene]-5,5'-dimethanol,decahydro-6'-hydroxy-5-(2-hydroxyethyl)-2',5',8'a-trimethyl-,(1'R,2'R,4'aS,5S,5'R,6'S,8'aS)-;spiro[furan-2(3H),1'(2'H)-naphthalene]-5,5'-dimethanol, decahydro-6'-hydroxy-5-(2-hydroxyethyl)-2',5',8'a-trimethyl-, (2R,2'R,5S,5'R,6'S,8'aS)-;(2R,4'aα,5S)-3',4,4',4a',5,5',6',7',8',8a'-Decahydro-6'β-hydroxy-5-(2-hydroxyethyl)-2'α,5',8'aβ-trimethylspiro[furan-2(3H),1'(2'H)-naphthalene]-5,5'α-dimethanol;LAGOCHILIN(P);Lagochiline;LAGOCHILINE (P);Spiro[furan-2(3H),1'(2'H)-naphthalene]-5,5'-dimethanol,decahydro-6'-hydroxy-5-(2-hydroxyethyl)-2',5',8'a-trimethyl-,(1'R,2'R,;23554-81-6;Labdane-3beta,15,16,18-tetrol, 9,13-epoxy-;A-dimethanol;DTXSID30392905;S62BXK5HES;Lagochilin;SPIRO(FURAN-2(3H),1'(2'H)-NAPHTHALENE)-5,5'-DIMETHANOL, DECAHYDRO-6'-HYDROXY-5-(2-HYDROXYETHYL)-2',5',8'A-TRIMETHYL-, (1'R-(1'.ALPHA.(S*),2'.ALPHA.,4'A.ALPHA.,5'.ALPHA.,6'.BETA.,8'A.BETA.))-;(2R,4'aalpha,5S)-3',4,4',4a',5,5',6',7',8',8a'-Decahydro-6'beta-hydroxy-5-(2-hydroxyethyl)-2'alpha,5',8'abeta-trimethylspiro(furan-2(3H),1'(2'H)-naphthalene)-5,5'alpha-dimethanol;Lagochillin;A-trimethylspiro[furan-2(3H),1'(2'H)-naphthalene]-5,5';(1R,2S,4aS,5R,5'S,6R,8aS)-5'-(2-hydroxyethyl)-1,5'-bis(hydroxymethyl)-1,4a,6-trimethylspiro[3,4,6,7,8,8a-hexahydro-2H-naphthalene-5,2'-oxolane]-2-ol;131898-43-6;(1R, 2S, 4aS, 5R, 5'S, 6R, 8aS)-5'-(2-hydroxyethyl)-1, 5'-bis(hydroxymethyl)-1, 4a, 6-trimethylspiro[3, 4, 6, 7, 8, 8a-hexahydro-2H-naphthalene-5, 2'-oxolane]-2-ol;UNII-S62BXK5HES;Spiro(furan-2(3H),1'(2'H)-naphthalene)-5,5'-dimethanol, decahydro-6'-hydroxy-5-(2-hydroxyethyl)-2',5',8'a-trimethyl-, (1'R-(1'alpha(S*),2'alpha,4'aalpha,5'alpha,6'beta,8'abeta))-;Q13553949;(1'R,2'R,4'As,5S,5'R,6'S,8'as)-decahydro-6'-hydroxy-5-(2-hydroxyethyl)-2',5',8'a-trimethylspiro(furan-2(3H),1'(2'H)-naphthalene)-5,5'-dimethanol;LABDANE-3.BETA.,15,16,18-TETROL, 9,13-EPOXY-;A,5',8'a;CHEMBL2165226;(2R,4'a;A,5S)-3',4,4',4a',5,5',6',7',8',8a'-Decahydro-6';(2R,4'A.ALPHA.,5S)-3',4,4',4A',5,5',6',7',8',8A'-DECAHYDRO-6'.BETA.-HYDROXY-5-(2-HYDROXYETHYL)-2'.ALPHA.,5',8'A.BETA.-TRIMETHYLSPIRO(FURAN-2(3H),1'(2'H)-NAPHTHALENE)-5,5'.ALPHA.-DIMETHANOL;A-hydroxy-5-(2-hydroxyethyl)-2';CHEBI:167853;(2R,4'aalpha,5S)-3',4,4',4a',5,5',6',7',8',8a'-Decahydro-6'beta-hydroxy-5-(2-hydroxyethyl)-2'alpha,5',8'abeta-trimethylspiro[furan-2(3H),1'(2'H)-naphthalene]-5,5'alpha-dimethanol;HY-118705;CS-0068284;

标识符

InChIKey:
XYPPDQHBNJURHU-IPOQXWOTSA-N
Inchi:
1S/C20H36O5/c1-14-4-5-15-17(2,12-22)16(24)6-7-18(15,3)20(14)9-8-19(13-23,25-20)10-11-21/h14-16,21-24H,4-13H2,1-3H3/t14-,15+,16+,17+,18+,19+,20-/m1/s1
SMILES:
O1[C@](CO)(CCO)CC[C@@]21[C@H](C)CC[C@H]1[C@](C)(CO)[C@H](CC[C@]21C)O

兔唇花灵(23554-81-6)物化性质

实验特性

  • LogP : 1.85480
  • PSA : 90.15000
  • 折射率 : 1.555
  • 沸点 : 518.2°Cat760mmHg
  • 闪点 : 267.2°C
  • 密度 : 1.18

计算特性

  • 精确分子量 : 356.256
  • 氢键供体数量 : 4
  • 氢键受体数量 : 5
  • 可旋转化学键数量 : 4
  • 同位素质量 : 356.256
  • 重原子数量 : 25
  • 复杂度 : 499
  • 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 : 7
  • 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) : 2.1
  • 拓扑分子极性表面积 : 90.2Ų

兔唇花灵(23554-81-6)推荐厂家 更多厂家(5)

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
上海甄准生物科技有限公司 13816009161
021-68920155
姜经理13816009161 3001086693
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上海惠诚生物科技有限公司 18018625233文俊 2303607288
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
四川维克奇生物科技有限公司 13348961525杨洋 2851167780
询单

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