Name: Wilfornine A
Rating: 5 (10 reviews)

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sdf 文件

结构编辑

类似物检索

HIT ID:HIT214314619
Cas No:345954-00-9
常用名:Wilfornine A
别名:雷公藤宁碱A
IUPAC:19,20,22,23,25-pentakis(acetyloxy)-21-[(acetyloxy)methyl]-26-hydroxy-3,15,26-trimethyl-6,16-dioxo-2,5,17-trioxa-11-azapentacyclo[16.7.1.0^{1,21}.0^{3,24}.0^{7,12}]hexacosa-7(12),8,10-trien-15-yl benzoate
IUPAC:19,20,22,23,25-pentakis(acetyloxy)-21-[(acetyloxy)methyl]-26-hydroxy-3,15,26-trimethyl-6,16-dioxo-2,5,17-trioxa-11-azapentacyclo[16.7.1.0^{1,21}.0^{3,24}.0^{7,12}]hexacosa-7(12),8,10-trien-15-yl benzoate
InChI key:YJDNHPICMWQYIV-UHFFFAOYSA-N

分子式:C45H51NO20
分子量:925.89
氢键供体数 (HBD):
氢键受体数 (HBA):
LogP:
SMILES:CC(=O)OCC12C(OC(C)=O)C(OC(C)=O)C3C(OC(C)=O)C11OC3(C)COC(=O)c3cccnc3CCC(C)(OC(=O)c3ccccc3)C(=O)OC(C(OC(C)=O)C2OC(C)=O)C1(C)O |TLB:18:17:24.23:5.11.6|
SMILES:CC(=O)OCC12C(OC(C)=O)C(OC(C)=O)C3C(OC(C)=O)C11OC3(C)COC(=O)c3cccnc3CCC(C)(OC(=O)c3ccccc3)C(=O)OC(C(OC(C)=O)C2OC(C)=O)C1(C)O |TLB:18:17:24.23:5.11.6|

Wilfornine A, a natural product derived from Schisandra sphenanthera, is a bioactive compound.

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