Calonyctin A-2d
HIT214319129
sdf文件结构编辑类似物检索
HIT ID: HIT214319129
Cas No: 151864-96-9
分子式: C45H78O20
分子量: 939.099
常用名: Calonyctin A-2d
氢键受体数 (HBA):
氢键供体数 (HBD):
LogP:
IUPAC: 6,25,26,32-tetrahydroxy-5,24,31-trimethyl-10-oxo-20-pentyl-33-[(3,4,5-trihydroxy-6-methyloxan-2-yl)oxy]-2,4,9,21,23,28,30-heptaoxatetracyclo[27.3.1.0^{3,8}.0^{22,27}]tritriacontan-7-yl 3-hydroxy-2-methylbutanoate
IUPAC: 6,25,26,32-tetrahydroxy-5,24,31-trimethyl-10-oxo-20-pentyl-33-[(3,4,5-trihydroxy-6-methyloxan-2-yl)oxy]-2,4,9,21,23,28,30-heptaoxatetracyclo[27.3.1.0^{3,8}.0^{22,27}]tritriacontan-7-yl 3-hydroxy-2-methylbutanoate
SMILES: CCCCCC1CCCCCCCCCC(=O)OC2C(OC(C)C(O)C2OC(=O)C(C)C(C)O)OC2C(O)C(C)OC(OC3C(O)C(O)C(C)OC3O1)C2OC1OC(C)C(O)C(O)C1O
SMILES: CCCCCC1CCCCCCCCCC(=O)OC2C(OC(C)C(O)C2OC(=O)C(C)C(C)O)OC2C(O)C(C)OC(OC3C(O)C(O)C(C)OC3O1)C2OC1OC(C)C(O)C(O)C1O
InChI key: DRAKJGOJAYUMIJ-UHFFFAOYSA-N
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