Name: Rauvovertine A
Rating: 5 (10 reviews)

有库存

sdf 文件

结构编辑

类似物检索

HIT ID:HIT214317150
Cas No:2055073-75-9
常用名:Rauvovertine A
别名:2055073-71-5, 17-epi-Rauvovertine A
IUPAC:(2S,13S,15S,16R,17R,19R,20R,21R)-19-methyl-18-oxa-1,11-diazahexacyclo[11.8.0.0^{2,16}.0^{4,12}.0^{5,10}.0^{15,20}]henicosa-4(12),5,7,9-tetraene-17,21-diol
IUPAC:(2S,13S,15S,16R,17R,19R,20R,21R)-19-methyl-18-oxa-1,11-diazahexacyclo[11.8.0.0^{2,16}.0^{4,12}.0^{5,10}.0^{15,20}]henicosa-4(12),5,7,9-tetraene-17,21-diol
InChI key:AWYNNQCKGSFTMD-NMLSZAJLSA-N

分子式:C19H22N2O3
分子量:326.396
氢键供体数 (HBD):
氢键受体数 (HBA):
LogP:
SMILES:[H][C@]12C[C@@]3([H])[C@]4([H])[C@@H](C)O[C@@H](O)[C@@]3([H])[C@]([H])(Cc3c1[nH]c1ccccc31)N2[C@@H]4O |TLB:28:27:14.12:1.2,18:1:14.12:27.5,16:14:1.2:27.5,THB:2:3:27.26.14:7.9.10,7:5:14.12:1.2,10:12:1.2:27.5|
SMILES:[H][C@]12C[C@@]3([H])[C@]4([H])[C@@H](C)O[C@@H](O)[C@@]3([H])[C@]([H])(Cc3c1[nH]c1ccccc31)N2[C@@H]4O |TLB:28:27:14.12:1.2,18:1:14.12:27.5,16:14:1.2:27.5,THB:2:3:27.26.14:7.9.10,7:5:14.12:1.2,10:12:1.2:27.5|

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