Name: 14-Dehydrobrowniine
Rating: 5 (10 reviews)

有库存

sdf 文件

结构编辑

类似物检索

HIT ID:HIT214317161
Cas No:4829-56-5
常用名:14-Dehydrobrowniine
IUPAC:(2R,3S,5R,6S,8R,9S,10S,13S,16S,17R,18S)-11-ethyl-8,9-dihydroxy-6,16,18-trimethoxy-13-(methoxymethyl)-11-azahexacyclo[7.7.2.1^{2,5}.0^{1,10}.0^{3,8}.0^{13,17}]nonadecan-4-one
IUPAC:(2R,3S,5R,6S,8R,9S,10S,13S,16S,17R,18S)-11-ethyl-8,9-dihydroxy-6,16,18-trimethoxy-13-(methoxymethyl)-11-azahexacyclo[7.7.2.1^{2,5}.0^{1,10}.0^{3,8}.0^{13,17}]nonadecan-4-one
InChI key:MWOQLGAENOKSHS-ILALHHSVSA-N

分子式:C25H39NO7
分子量:465.587
氢键供体数 (HBD):
氢键受体数 (HBA):
LogP:
SMILES:[H][C@]12C[C@]3([H])[C@]([H])(C1=O)[C@](O)(C[C@@H]2OC)[C@@]1(O)[C@@H](OC)[C@@]2([H])C33[C@H](CC[C@@]2(COC)CN(CC)[C@]13[H])OC |TLB:32:31:22:15.17,9:15:22:26.30.31,3:22:26.30.31:15.17,2:3:34:20.17,7:5:34:20.17,THB:23:22:26.30.31:15.17,27:26:22:15.17,31:34:20.17:9.5.3,16:15:22:26.30.31,17:20:30.31.34:23.25.24,18:17:22:26.30.31,18:17:34:9.5.3,10:9:34:20.17,11:9:34:20.17,25:26:22:15.17|
SMILES:[H][C@]12C[C@]3([H])[C@]([H])(C1=O)[C@](O)(C[C@@H]2OC)[C@@]1(O)[C@@H](OC)[C@@]2([H])C33[C@H](CC[C@@]2(COC)CN(CC)[C@]13[H])OC |TLB:32:31:22:15.17,9:15:22:26.30.31,3:22:26.30.31:15.17,2:3:34:20.17,7:5:34:20.17,THB:23:22:26.30.31:15.17,27:26:22:15.17,31:34:20.17:9.5.3,16:15:22:26.30.31,17:20:30.31.34:23.25.24,18:17:22:26.30.31,18:17:34:9.5.3,10:9:34:20.17,11:9:34:20.17,25:26:22:15.17|

14-Dehydrobrowniine是一种天然产物，属于毛茛科翠雀属，其产品编号为 TN6072，CAS号为 4829-56-5。14-Dehydrobrowniine可用作对照参考。

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