Name: Glysperin B
Rating: 5 (10 reviews)

有库存

sdf 文件

结构编辑

类似物检索

HIT ID:HIT219600075
Cas No:78213-55-5
常用名:Glysperin B
IUPAC:4-{[4-({4-[(5-{[5-amino-3-(2-aminopropanamido)-4-hydroxy-6-methyloxan-2-yl]oxy}-3,4-dihydroxy-6-(hydroxymethyl)oxan-2-yl)oxy]-3,5-dihydroxy-6-methylideneoxan-2-yl}oxy)-3-hydroxy-5-(hydroxymethyl)oxolan-2-yl]oxy}-N-{3-[(4-aminobutyl)amino]propyl}benzamide
IUPAC:4-{[4-({4-[(5-{[5-amino-3-(2-aminopropanamido)-4-hydroxy-6-methyloxan-2-yl]oxy}-3,4-dihydroxy-6-(hydroxymethyl)oxan-2-yl)oxy]-3,5-dihydroxy-6-methylideneoxan-2-yl}oxy)-3-hydroxy-5-(hydroxymethyl)oxolan-2-yl]oxy}-N-{3-[(4-aminobutyl)amino]propyl}benzamide
InChI key:PGEKDAOSVRPCSY-UHFFFAOYSA-N

分子式:C40H66N6O18
分子量:918.992
氢键供体数 (HBD):
氢键受体数 (HBA):
LogP:
SMILES:CC(N)C(=O)NC1C(O)C(N)C(C)OC1OC1C(O)C(O)C(OC2C(O)C(OC3C(CO)OC(Oc4ccc(cc4)C(=O)NCCCNCCCCN)C3O)OC(=C)C2O)OC1CO
SMILES:CC(N)C(=O)NC1C(O)C(N)C(C)OC1OC1C(O)C(O)C(OC2C(O)C(OC3C(CO)OC(Oc4ccc(cc4)C(=O)NCCCNCCCCN)C3O)OC(=C)C2O)OC1CO

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