Name: Fibraurin
Rating: 5 (10 reviews)

有库存

sdf 文件

结构编辑

类似物检索

HIT ID:HIT214312022
Cas No:25254-84-6
常用名:Fibraurin
IUPAC:(1R,3S,5R,11R,12R,13S,15S)-5-(furan-3-yl)-12-hydroxy-3,11-dimethyl-6,14,16-trioxapentacyclo[10.3.2.0^{2,11}.0^{3,8}.0^{13,15}]heptadec-8-ene-7,17-dione
IUPAC:(1R,3S,5R,11R,12R,13S,15S)-5-(furan-3-yl)-12-hydroxy-3,11-dimethyl-6,14,16-trioxapentacyclo[10.3.2.0^{2,11}.0^{3,8}.0^{13,15}]heptadec-8-ene-7,17-dione
InChI key:XUFRUKAPNGPYSR-OHLXRHPZSA-N

分子式:C20H20O7
分子量:372.373
氢键供体数 (HBD):
氢键受体数 (HBA):
LogP:
SMILES:C[C@@]12C[C@@H](OC(=O)C1=CC[C@]1(C)C2[C@H]2OC(=O)[C@]1(O)[C@H]1O[C@@H]21)c1ccoc1 |c:8,TLB:1:12:14.15:19.21,THB:9:10:14.15:19.21,11:10:14.15:19.21,20:19:10.12:14.15|
SMILES:C[C@@]12C[C@@H](OC(=O)C1=CC[C@]1(C)C2[C@H]2OC(=O)[C@]1(O)[C@H]1O[C@@H]21)c1ccoc1 |c:8,TLB:1:12:14.15:19.21,THB:9:10:14.15:19.21,11:10:14.15:19.21,20:19:10.12:14.15|

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