14019-66-0 (钩藤碱F,Spiro[3H-indole-3,6'(4'aH)-[1H]pyrano[3,4-f]indolizine]-4'-carboxylicacid, 1,2,5',5'a,7',8',10',10'a-octahydro-1'-methyl-2-oxo-, methyl ester,(1'S,3R,4'aS,5'aR,10'aS)-)

CAS号:
14019-66-0
中文名称:
钩藤碱F
英文名称:
Spiro[3H-indole-3,6'(4'aH)-[1H]pyrano[3,4-f]indolizine]-4'-carboxylicacid, 1,2,5',5'a,7',8',10',10'a-octahydro-1'-methyl-2-oxo-, methyl ester,(1'S,3R,4'aS,5'aR,10'aS)-
分子式:
C21H24N2O4
分子量:
368.426265716553
植物源:

钩藤碱F(14019-66-0)名称与标识符

名称

中文别名:
恩卡林碱F;钩藤碱F;恩卡林碱 F;
英文别名:
Spiro[3H-indole-3,6'(4'aH)-[1H]pyrano[3,4-f]indolizine]-4'-carboxylicacid, 1,2,5',5'a,7',8',10',10'a-octahydro-1'-methyl-2-oxo-, methyl ester,(1'S,3R,4'aS,5'aR,10'aS)-;Methyl (3β,19β)-19-methyl-2-oxoformosanan-16-carboxylate;Spiro[3H-indole-3,6'(4'aH)-[1H]pyrano[3,4-f]indolizine]-4'-carboxylicacid, 1,2,5',5'a,7',8',10',10'a-octahydro-1'-methyl-2-ox;Spiro[3H-indole-3,6'(4'aH)-[1H]pyrano[3,4-f]indolizine]-4'-carboxylicacid, 1,2,5',5'a,7',8',10...;(1'S,3R,4'aS,5'aR,10'aS)-1,2,5',5'a,7',8',10',10'a-Octahydro-1'-methyl-2-oxospiro[3H-indole-3,6'(4'aH)-[1H]pyrano[3,4-f]indolizine]-4'-carboxylic acid methyl ester;Uncarine F;(3R,20S)-19α-Methyl-2-oxoformosanan-16-carboxylic acid methyl ester;CHEBI:81206;14019-66-0;Speciofiline;Q27155151;FORMOSANAN-16-CARBOXYLIC ACID, 19-METHYL-2-OXO-, METHYL ESTER, (3.BETA.,19.ALPHA.,20.ALPHA.)-;METHYL (7alpha,19alpha,20alpha)-19-METHYL-2-OXOFORMOSANAN-16-CARBOXYLATE;9968028I8W;Methyl 1,2,5',5'a,7',8',10',10'a-octahydro-1'-methyl-2-oxospiro(3H-indole-3,6'(4'aH)-(1H)pyrano(3,4-f)indolizine)-4'-carboxylate (1'S-(1'alpha,4'aalpha,5'abeta,6'beta,10'aalpha))-;METHYL (7.ALPHA.,19.ALPHA.,20.ALPHA.)-19-METHYL-2-OXOFORMOSANAN-16-CARBOXYLATE;FORMOSANAN-16-CARBOXYLIC ACID, 19-METHYL-2-OXO-, METHYL ESTER, (3beta,19alpha,20alpha)-;C17598;methyl (1S,4aS,5aR,6R,10aS)-1-methyl-2'-oxospiro[1,4a,5,5a,7,8,10,10a-octahydropyrano[3,4-f]indolizine-6,3'-1H-indole]-4-carboxylate;UNCARINE F (CONSTITUENT OF CAT'S CLAW);UNII-9968028I8W;Spiro(3H-indole-3,6'(4'aH)-(1H)pyrano(3,4-f)indolizine)-4'-carboxylic acid, 1,2,5',5'a,7',8',10',10'a-octahydro-1'-methyl-2-oxo-, methyl ester, (1'S-(1'alpha,4'aalpha,5'abeta,6'beta,10'aalpha))-;UNCARINE F (CONSTITUENT OF CAT'S CLAW) [DSC];ConMedNP.1318;Uncarin D;MLS000728610;7-Isopteropodine;MLS000728614;Rauniticine-allo-oxindole A;Mitraphylline;MLSMR;allo-Isopteropodine;Ajmalicine oxindole A;Ajmalicine oxindole B;Rubradinine;SMR000470795;SMR000470796;Isomitraphylline;allo-Pteropodine;Isoformosanine;5171-37-9;Rauniticine oxindole A;Isopteropodine;509-80-8;SMR000440716;Uncarine E;Uncarine C;Uncarine D;Uncarine A;Speciophylline;Uncarine B;Pteropodine;MLS000863603;

标识符

InChIKey:
JMIAZDVHNCCPDM-PMJXBNNDSA-N
Inchi:
1S/C21H24N2O4/c1-12-14-10-23-8-7-21(16-5-3-4-6-17(16)22-20(21)25)18(23)9-13(14)15(11-27-12)19(24)26-2/h3-6,11-14,18H,7-10H2,1-2H3,(H,22,25)/t12-,13-,14-,18+,21+/m0/s1
SMILES:
O1C=C(C(=O)OC)[C@@H]2[C@H]([C@@H]1C)CN1CC[C@]3(C(NC4C=CC=CC3=4)=O)[C@H]1C2

钩藤碱F(14019-66-0)物化性质

实验特性

  • 折射率 : 1.635
  • 沸点 : 555.2±50.0 °C at 760 mmHg
  • 蒸气压 : 0.0±1.5 mmHg at 25°C
  • 闪点 : 289.6±30.1 °C
  • 密度 : 1.33

计算特性

  • 精确分子量 : 368.174
  • 氢键供体数量 : 1
  • 氢键受体数量 : 5
  • 可旋转化学键数量 : 2
  • 同位素质量 : 368.174
  • 重原子数量 : 27
  • 复杂度 : 692
  • 同位素原子数量 : 0
  • 确定原子立构中心数量 : 5
  • 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) : 1.6
  • 拓扑分子极性表面积 : 67.9A^2

钩藤碱F(14019-66-0)推荐厂家 更多厂家(4)

公司名称手机号/电话联系人QQ微信询单
云南西力生物技术股份有限公司 18788556290
+86-871-65217109
郑经理 1477035482
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上海源叶生物科技有限公司 15026964105
15026964105
汤思磊 2881489226
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上海源叶生物科技有限公司 15026964105
15026964105
汤思磊 2881489226
询单
四川维克奇生物科技有限公司 13348961525杨洋 2851167780
询单

钩藤碱F(14019-66-0)相关文献

钩藤碱F(14019-66-0)参考资料

Reaxys RN:
PubChem CID: