(2R,4R,7R)-8-benzyl-4-(benzyloxy)-13,15-dioxa-8-azatetracyclo[8.7.0.0²,⁷.0¹²,¹⁶]heptadeca-1(17),10,12(16)-trien-9-one
AlkaPlorer ID: AK020576
Synonym: None
IUPAC Name: (2R,4aR,11bR)-5-benzyl-2-phenylmethoxy-1,2,3,4,4a,11b-hexahydro-[1,3]dioxolo[4,5-j]phenanthridin-6-one
Structure
SMILES: O=C1C2=CC3=C(C=C2[C@H]2C[C@H](OCC4=CC=CC=C4)CC[C@H]2N1CC1=CC=CC=C1)OCO3
InChI: InChI=1S/C28H27NO4/c30-28-24-15-27-26(32-18-33-27)14-22(24)23-13-21(31-17-20-9-5-2-6-10-20)11-12-25(23)29(28)16-19-7-3-1-4-8-19/h1-10,14-15,21,23,25H,11-13,16-18H2/t21-,23-,25-/m1/s1
InChIKey: DSTSQAROMMWVIN-GZGNHOFSSA-N
Source
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Properties Information
Molecule Weight: 441.5270000000002
TPSA？: 48.0
MolLogP？: 5.292800000000006
Number of H-Donors: 0
Number of H-Acceptors: 4
RingCount: 6
Activities Information
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