Ansatrienin B; 23-Deoxy
AlkaPlorer ID: AK288088
Synonym: 19-Deoxymycotrienin II, Trienomycin A, Antibiotic T 23X, T 23X
IUPAC Name: (15,22-dihydroxy-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=CC(=CC(O)=C2)NC(=O)C1
InChI: InChI=1S/C36H50N2O7/c1-24-14-13-15-27-20-29(22-30(39)21-27)38-33(40)23-31(44-4)18-11-6-5-7-12-19-32(25(2)34(24)41)45-36(43)26(3)37-35(42)28-16-9-8-10-17-28/h5-7,11-12,14,18,20-22,25-26,28,31-32,34,39,41H,8-10,13,15-17,19,23H2,1-4H3,(H,37,42)(H,38,40)
InChIKey: WACCDLYIHBADOZ-UHFFFAOYSA-N
Source
Properties Information
Molecule Weight: 622.8030000000005
TPSA？: 134.19
MolLogP？: 5.680800000000007
Number of H-Donors: 4
Number of H-Acceptors: 7
RingCount: 3
Activities Information
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