HIT101089265 - 10-hydroxy-6,10,23-trimethyl-20-{[3,4,5-trihydroxy-6-(hydroxymethyl)oxan-2-yl]oxy}-4-azahexacyclo[12.11.0.0^{2,11}.0^{4,9}.0^{15,24}.0^{18,23}]pentacosan-17-one, N070-0005

sdf文件结构编辑类似物检索

HIT ID: HIT101089265

Cas No: -

分子式: C33H53NO8

分子量: 591.786

常用名: 10-hydroxy-6,10,23-trimethyl-20-{[3,4,5-trihydroxy-6-(hydroxymethyl)oxan-2-yl]oxy}-4-azahexacyclo[12.11.0.0^{2,11}.0^{4,9}.0^{15,24}.0^{18,23}]pentacosan-17-one, N070-0005

氢键受体数 (HBA): 10

氢键供体数 (HBD): 5

LogP: 2.106

IUPAC: 10-hydroxy-6,10,23-trimethyl-20-{[3,4,5-trihydroxy-6-(hydroxymethyl)oxan-2-yl]oxy}-4-azahexacyclo[12.11.0.0^{2,11}.0^{4,9}.0^{15,24}.0^{18,23}]pentacosan-17-one

SMILES: CC1CCC2N(C1)CC1C3CC4C(CC(=O)C5CC(CCC45C)OC4OC(CO)C(O)C(O)C4O)C3CCC1C2(C)O

InChI key: DHQFYEJMFMYGCV-UHFFFAOYSA-N