Name: Sphaeropsidin B
Rating: 5 (10 reviews)

有库存

sdf 文件

结构编辑

类似物检索

HIT ID:HIT214320281
Cas No:39022-38-3
常用名:Sphaeropsidin B
别名:Pinowiltin, LL-S491gamma, LLS491gamma, LL S491gamma, Antibiotic LL-S491gamma
别名:Pinowiltin, LL-S491gamma, LLS491gamma, LL S491gamma, Antibiotic LL-S491gamma
IUPAC:(1R,2R,5R,8R,9S,10S)-5-ethenyl-2,8,9-trihydroxy-5,11,11-trimethyl-16-oxatetracyclo[7.5.2.0^{1,10}.0^{2,7}]hexadec-6-en-15-one
IUPAC:(1R,2R,5R,8R,9S,10S)-5-ethenyl-2,8,9-trihydroxy-5,11,11-trimethyl-16-oxatetracyclo[7.5.2.0^{1,10}.0^{2,7}]hexadec-6-en-15-one
InChI key:XJXDJAQAAAVDCT-RHOFUAETSA-N

分子式:C20H28O5
分子量:348.439
氢键供体数 (HBD):
氢键受体数 (HBA):
LogP:
SMILES:[H][C@@]12[C@]3(O)OC(=O)[C@@]1(CCCC2(C)C)[C@@]1(O)CC[C@](C)(C=C)C=C1[C@H]3O |c:24,TLB:15:14:1:4.5,25:24:1:4.5,16:14:1:4.5,THB:11:1:4.5:14.24.23|
SMILES:[H][C@@]12[C@]3(O)OC(=O)[C@@]1(CCCC2(C)C)[C@@]1(O)CC[C@](C)(C=C)C=C1[C@H]3O |c:24,TLB:15:14:1:4.5,25:24:1:4.5,16:14:1:4.5,THB:11:1:4.5:14.24.23|

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