Chemical Compound

(1S,2S,3S,3 aR,4R,4 S,5 S)-4-(1-Hydroxy-1-methylethyl)-3 a,4 ,5 ,6 -tetrahydro-5 -(methoxycarbonyl)-1,3,3 a,4 ,7 -pentamethyl-6 -oxospiro[cyclohexane-2,2 (3 H)-benzofuran]-3-propanoic acid

(1S,2S,3S,3   aR,4R,4   S,5   S)-4-(1-Hydroxy-1-methylethyl)-3   a,4   ,5   ,6   -tetrahydro-5   -(methoxycarbonyl)-1,3,3   a,4   ,7   -pentamethyl-6   -oxospiro[cyclohexane-2,2   (3   H)-benzofuran]-3-propanoic acid 结构式
Primary record

(1S,2S,3S,3 aR,4R,4 S,5 S)-4-(1-Hydroxy-1-methylethyl)-3 a,4 ,5 ,6 -tetrahydro-5 -(methoxycarbonyl)-1,3,3 a,4 ,7 -pentamethyl-6 -oxospiro[cyclohexane-2,2 (3 H)-benzofuran]-3-propanoic acid

库存
550 克
纯度
98.1 %

化合物标识与属性

PubChem CID
132524229
SMILES
C[C@H]1CC[C@H]([C@]([C@]12C[C@@]3([C@H]([C@@H](C(=O)C(=C3O2)C)C(=O)OC)C)C)(C)CCC(=O)O)C(C)(C)O
Canonical SMILES
COC(=O)[C@@H]1C(=O)C(C)=C2O[C@@]3(C[C@]2(C)[C@H]1C)[C@@H](C)CC[C@@H](C(C)(C)O)[C@]3(C)CCC(=O)O

名称与同义词

  • Asnovolin D
  • RefChem:114594
  • CHEMBL3965880
  • CHEBI:205691
  • J3.553.478D
  • (1S,2S,3S,3 aR,4R,4 S,5 S)-4-(1-Hydroxy-1-methylethyl)-3 a,4 ,5 ,6 -tetrahydro-5 -(methoxycarbonyl)-1,3,3 a,4 ,7 -pentamethyl-6 -oxospiro[cyclohexane-2,2 (3 H)-benzofuran]-3-propanoic acid
  • 3-((1'S,2S,3'S,3aR,4S,5S,6'R)-6'-(2-hydroxypropan-2-yl)-5-methoxycarbonyl-1',3',3a,4,7-pentamethyl-6-oxospiro(4,5-dihydro-3H-1-benzofuran-2,2'-cyclohexane)-1'-yl)propanoic acid
  • 3-((2S,2's,3AR,4S,5S,5'r,6's)-5'-(2-hydroxypropan-2-yl)-5-(methoxycarbonyl)-2',3a,4,6',7-pentamethyl-6-oxo-3a,4,5,6-tetrahydro-3H-spiro(1-benzofuran-2,1'-cyclohexane)-6'-yl)propanoate
  • 3-[(1'S,2S,3'S,3aR,4S,5S,6'R)-6'-(2-hydroxypropan-2-yl)-5-methoxycarbonyl-1',3',3a,4,7-pentamethyl-6-oxospiro[4,5-dihydro-3H-1-benzofuran-2,2'-cyclohexane]-1'-yl]propanoic acid
  • 3-[(1'S,2S,3'S,3aR,4S,5S,6'R)-6'-(2-hydroxypropan-2-yl)-5-methoxycarbonyl-1',3',3a,4,7-pentamethyl-6-oxospiro[4,5-dihydro-3H-1-benzouran-2,2'-cyclohexane]-1'-yl]propanoic acid
  • 3-[(2S,2'S,3'R,3aR,4S,5S,6'S)-3'-(2-hydroxypropan-2-yl)-5-(methoxycarbonyl)-2',3a,4,6',7-pentamethyl-6-oxo-3a,4,5,6-tetrahydro-3H-spiro[1-benzofuran-2,1'-cyclohexan]-2'-yl]propanoic acid
  • 3-[(2S,2's,3AR,4S,5S,5'r,6's)-5'-(2-hydroxypropan-2-yl)-5-(methoxycarbonyl)-2',3a,4,6',7-pentamethyl-6-oxo-3a,4,5,6-tetrahydro-3H-spiro[1-benzofuran-2,1'-cyclohexane]-6'-yl]propanoate