Ansatrienin B
AlkaPlorer ID: AK288084
Synonym: Mycotrienin II, T 23II, Antibiotic T 23II
IUPAC Name: (15,22,24-trihydroxy-5-methoxy-14,16-dimethyl-3-oxo-2-azabicyclo[18.3.1]tetracosa-1(23),6,8,10,16,20(24),21-heptaen-13-yl) 2-(cyclohexanecarbonylamino)propanoate
Structure
SMILES: COC1C=CC=CC=CCC(OC(=O)C(C)NC(=O)C2CCCCC2)C(C)C(O)C(C)=CCCC2=C(O)C(=CC(O)=C2)NC(=O)C1
InChI: InChI=1S/C36H50N2O8/c1-23-14-13-17-27-20-28(39)21-30(34(27)42)38-32(40)22-29(45-4)18-11-6-5-7-12-19-31(24(2)33(23)41)46-36(44)25(3)37-35(43)26-15-9-8-10-16-26/h5-7,11-12,14,18,20-21,24-26,29,31,33,39,41-42H,8-10,13,15-17,19,22H2,1-4H3,(H,37,43)(H,38,40)
InChIKey: VVJDHJZQBGWPEQ-UHFFFAOYSA-N
Source
Properties Information
Molecule Weight: 638.8020000000004
TPSA？: 154.42
MolLogP？: 5.386400000000007
Number of H-Donors: 5
Number of H-Acceptors: 8
RingCount: 3
Activities Information
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