110311-42-7 (((10R)-3c-Hydroxy-4.4.10r.13t.14c-pentamethyl-17t-((R)-1.5-dimethyl-hexen-(4)-yl)-(5tH.9tH)-Delta7-tetradecahydro-1H-cyclopenta[a]phenanthren)

CAS号:
110311-42-7
英文名称:
(10R)-3c-Hydroxy-4.4.10r.13t.14c-pentamethyl-17t-((R)-1.5-dimethyl-hexen-(4)-yl)-(5tH.9tH)-Delta7-tetradecahydro-1H-cyclopenta[a]phenanthren
分子式:
C30H50O
分子量:
426.717
植物源:

(10R)-3c-Hydroxy-4.4.10r.13t.14c-pentamethyl-17t-((R)-1.5-dimethyl-hexen-(4)-yl)-(5tH.9tH)-Delta7-tetradecahydro-1H-cyclopenta[a]phenanthren(110311-42-7)名称与标识符

名称

英文别名:
(10R)-3c-Hydroxy-4.4.10r.13t.14c-pentamethyl-17t-((R)-1.5-dimethyl-hexen-(4)-yl)-(5tH.9tH)-Delta7-tetradecahydro-1H-cyclopenta[a]phenanthren;(5alpha)-eupha-7,24-dien-3beta-ol;3beta-Hydroxy-4.4.10.13.14-pentamethyl-17alpha-((R)-1.5-dimethyl-;5alpha-tirucalla-7,24-dien-3beta-ol;7,24-tirucalladien-3beta-ol;Delta7-tirucallol;tirucalla-7,21-dien-3beta-ol;tirucalla-7,24-dien-3beta-ol;tirucalla-7,24-dienol;

标识符

InChIKey:
DICCPNLDOZNSML-XGKJEQFASA-N
Inchi:
InChI=1S/C30H50O/c1-20(2)10-9-11-21(3)22-14-18-30(8)24-12-13-25-27(4,5)26(31)16-17-28(25,6)23(24)15-19-29(22,30)7/h10,12,21-23,25-26,31H,9,11,13-19H2,1-8H3/t21-,22+,23+,25+,26+,28-,29+,30-/m1/s1
SMILES:
CC(=CCC[C@@H](C)[C@@H]1CC[C@]2(C)C3=CC[C@H]4C(C)(C)[C@H](CC[C@]4(C)[C@H]3CC[C@@]12C)O)C

(10R)-3c-Hydroxy-4.4.10r.13t.14c-pentamethyl-17t-((R)-1.5-dimethyl-hexen-(4)-yl)-(5tH.9tH)-Delta7-tetradecahydro-1H-cyclopenta[a]phenanthren(110311-42-7)物化性质

计算特性

  • 氢键供体数量 : 1
  • 氢键受体数量 : 1
  • 可旋转化学键数量 : 4
  • 重原子数量 : 31

(10R)-3c-Hydroxy-4.4.10r.13t.14c-pentamethyl-17t-((R)-1.5-dimethyl-hexen-(4)-yl)-(5tH.9tH)-Delta7-tetradecahydro-1H-cyclopenta[a]phenanthren(110311-42-7)相关文献