Name: Halomicin A
Rating: 5 (10 reviews)

有库存

sdf 文件

结构编辑

类似物检索

HIT ID:HIT219600079
Cas No:56411-51-9
常用名:Halomicin A
别名:卤霉素 A
IUPAC:2,15,17,29-tetrahydroxy-27-[3-hydroxy-2-(1-hydroxyethyl)pyrrolidin-1-yl]-11-methoxy-3,7,12,14,16,18,22-heptamethyl-6,23-dioxo-8,30-dioxa-24-azatetracyclo[23.3.1.1^{4,7}.0^{5,28}]triaconta-1(29),2,4,9,19,21,25,27-octaen-13-yl acetate
IUPAC:2,15,17,29-tetrahydroxy-27-[3-hydroxy-2-(1-hydroxyethyl)pyrrolidin-1-yl]-11-methoxy-3,7,12,14,16,18,22-heptamethyl-6,23-dioxo-8,30-dioxa-24-azatetracyclo[23.3.1.1^{4,7}.0^{5,28}]triaconta-1(29),2,4,9,19,21,25,27-octaen-13-yl acetate
InChI key:QKZDEAZSGKLVSB-UHFFFAOYSA-N

分子式:C43H58N2O13
分子量:810.938
氢键供体数 (HBD):
氢键受体数 (HBA):
LogP:
SMILES:COC1C=COC2(C)Oc3c(C2=O)c2c(cc(NC(=O)C(C)=CC=CC(C)C(O)C(C)C(O)C(C)C(OC(C)=O)C1C)c(O)c2c(O)c3C)N1CCC(O)C1C(C)O
SMILES:COC1C=COC2(C)Oc3c(C2=O)c2c(cc(NC(=O)C(C)=CC=CC(C)C(O)C(C)C(O)C(C)C(OC(C)=O)C1C)c(O)c2c(O)c3C)N1CCC(O)C1C(C)O

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