Name: Trigothysoid P
Rating: 5 (10 reviews)

有库存

sdf 文件

结构编辑

类似物检索

HIT ID:HIT214317197
Cas No:1501943-10-7
常用名:Trigothysoid P
IUPAC:(1R,2S,5R,6S,7S,8R,10S,11S,14Z,16Z,18S,19S,22R,24R,25S,26R,28S,30S,31R,33S)-6,7,24,25-tetrahydroxy-5,10,24,31,33-pentamethyl-13-oxo-28-phenyl-4,12,27,29,32-pentaoxaoctacyclo[26.3.1.1^{19,22}.0^{1,8}.0^{2,26}.0^{3,5}.0^{7,11}.0^{25,30}]tritriaconta-14,16-dien-18-yl 3-methylbutanoate
IUPAC:(1R,2S,5R,6S,7S,8R,10S,11S,14Z,16Z,18S,19S,22R,24R,25S,26R,28S,30S,31R,33S)-6,7,24,25-tetrahydroxy-5,10,24,31,33-pentamethyl-13-oxo-28-phenyl-4,12,27,29,32-pentaoxaoctacyclo[26.3.1.1^{19,22}.0^{1,8}.0^{2,26}.0^{3,5}.0^{7,11}.0^{25,30}]tritriaconta-14,16-dien-18-yl 3-methylbutanoate
InChI key:RWZNHRBBFPIOQX-DNFVIXMQSA-N

分子式:C44H58O12
分子量:778.936
氢键供体数 (HBD):
氢键受体数 (HBA):
LogP:
SMILES:[H][C@]12CC[C@@]([H])([C@H]1C)[C@@H](OC(=O)CC(C)C)\C=C/C=C\C(=O)O[C@@]1([H])[C@@H](C)C[C@]3([H])[C@]1(O)[C@H](O)[C@@]1(C)OC1[C@@]1([H])[C@@]4([H])O[C@@]5(O[C@@]([H])([C@@H](C)[C@]31O5)[C@@]4(O)[C@](C)(O)C2)c1ccccc1 |c:17,19|
SMILES:[H][C@]12CC[C@@]([H])([C@H]1C)[C@@H](OC(=O)CC(C)C)\C=C/C=C\C(=O)O[C@@]1([H])[C@@H](C)C[C@]3([H])[C@]1(O)[C@H](O)[C@@]1(C)OC1[C@@]1([H])[C@@]4([H])O[C@@]5(O[C@@]([H])([C@@H](C)[C@]31O5)[C@@]4(O)[C@](C)(O)C2)c1ccccc1 |c:17,19|

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