N-[(2R)-1-[(10R,12R,13S,14R)-10-hydroxy-8-methoxy-14-(4-methoxyphenyl)-11-oxo-13-phenyl-4,6,15-trioxatetracyclo[7.6.0.0³,⁷.0¹⁰,¹⁴]pentadeca-1(9),2,7-triene-12-carbonyl]pyrrolidin-2-yl]-2-methylpropanamide
AlkaPlorer ID: AK101420
Synonym: None
IUPAC Name: N-[(2R)-1-[(10R,12R,13S,14R)-10-hydroxy-8-methoxy-14-(4-methoxyphenyl)-11-oxo-13-phenyl-4,6,15-trioxatetracyclo[7.6.0.03,7.010,14]pentadeca-1,3(7),8-triene-12-carbonyl]pyrrolidin-2-yl]-2-methylpropanamide
Structure
SMILES: COC1=CC=C([C@@]23OC4=CC5=C(OCO5)C(OC)=C4[C@]2(O)C(=O)[C@H](C(=O)N2CCC[C@@H]2N=C(O)C(C)C)[C@H]3C2=CC=CC=C2)C=C1
InChI: InChI=1S/C35H36N2O9/c1-19(2)32(39)36-25-11-8-16-37(25)33(40)26-27(20-9-6-5-7-10-20)35(21-12-14-22(42-3)15-13-21)34(41,31(26)38)28-23(46-35)17-24-29(30(28)43-4)45-18-44-24/h5-7,9-10,12-15,17,19,25-27,41H,8,11,16,18H2,1-4H3,(H,36,39)/t25-,26-,27-,34+,35+/m1/s1
InChIKey: BJIDEXYWQKFHOB-QPRNYPETSA-N
Source
Properties Information
Molecule Weight: 628.6780000000003
TPSA？: 136.35
MolLogP？: 4.451700000000002
Number of H-Donors: 2
Number of H-Acceptors: 9
RingCount: 7
Activities Information
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