methyl 13-hydroxy-19-methoxy-9-oxo-8,15'-dioxa-4,8',17,19'-tetraazaspiro[heptacyclo[11.10.1.1¹,?.0?,¹¹.0¹?,²?.0¹?,²³.0¹¹,²?]pentacosane-15,17'-hexacyclo[10.9.1.0¹,?.0²,?.0¹²,¹?.0¹?,²²]docosane]-2',4',6',9',18,20,22-heptaene-10'-carboxylate
AlkaPlorer ID: AK195850
Synonym: None
IUPAC Name: methyl 13'-hydroxy-19'-methoxy-9'-oxospiro[15-oxa-8,19-diazahexacyclo[10.9.1.01,9.02,7.012,16.019,22]docosa-2,4,6,9-tetraene-17,15'-8-oxa-4,17-diazaheptacyclo[11.10.1.11,4.07,11.017,24.018,23.011,25]pentacosa-18(23),19,21-triene]-10-carboxylate
Structure
SMILES: COC(=O)C1=C2NC3=CC=CC=C3C23CCN2CC4(CN5C6=C(OC)C=CC=C6C67CCN8CCC9OC(=O)CC9(CC(O)(C4)C56)C87)C4OCCC4(C1)C23
InChI: InChI=1S/C43H48N4O7/c1-51-28-9-5-7-26-31(28)47-23-38(20-41(50)21-40-19-30(48)54-29(40)10-14-45-15-12-43(26,35(40)45)36(41)47)22-46-16-11-42-25-6-3-4-8-27(25)44-32(42)24(33(49)52-2)18-39(34(42)46)13-17-53-37(38)39/h3-9,29,34-37,44,50H,10-23H2,1-2H3
InChIKey: UPBQNQKXSOAYQO-UHFFFAOYSA-N
Source
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Properties Information
Molecule Weight: 732.8779999999999
TPSA？: 113.04000000000002
MolLogP？: 3.483900000000002
Number of H-Donors: 2
Number of H-Acceptors: 11
RingCount: 13
Activities Information
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