20-hydroxy-6,23-dimethyl-4-azahexacyclo[12.11.0.0²,¹¹.0?,?.0¹?,²?.0¹?,²³]pentacosan-17-one

AlkaPlorer ID: AK120681

Synonym: None

IUPAC Name: (6S,23R)-20-hydroxy-6,23-dimethyl-4-azahexacyclo[12.11.0.02,11.04,9.015,24.018,23]pentacosan-17-one

Structure

SMILES: C[C@H]1CCC2CC3CCC4C(CC5C4CC(=O)C4CC(O)CC[C@@]45C)C3CN2C1

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InChI: InChI=1S/C26H41NO2/c1-15-3-5-17-9-16-4-6-19-20(22(16)14-27(17)13-15)11-23-21(19)12-25(29)24-10-18(28)7-8-26(23,24)2/h15-24,28H,3-14H2,1-2H3/t15-,16?,17?,18?,19?,20?,21?,22?,23?,24?,26+/m0/s1

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InChIKey: HACRWLXAPKHHLM-HDMFEEIWSA-N

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Properties Information

Molecule Weight: 399.61900000000026

TPSA: 40.54

MolLogP: 4.525400000000005

Number of H-Donors: 1

Number of H-Acceptors: 3

RingCount: 6

Activities Information

Organism Target Name Standard Type Standard Value Standard Units doi

Metabolism Information