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Periglaucine D

AlkaPlorer ID: AK056121

Synonym: '(+)-Periglaucine D', 'periglaucine D', 'Periglaucine D', '(7beta,8beta,10beta)-8,10-epoxy-7,8-dimethoxy-2,3-methylenebis(oxy)-16-propan-2-one-17-methyl-6-oxohasubanan'

IUPAC Name: (1S,11R,13S,14S,15R,19R)-14,15-dimethoxy-20-methyl-19-(2-oxopropyl)-5,7,21-trioxa-20-azahexacyclo[11.4.3.111,14.01,13.02,10.04,8]henicosa-2,4(8),9-trien-16-one

Structure

SMILES: CO[C@@H]1C(=O)C[C@]23C[C@H](CC(C)=O)N(C)[C@@]24C[C@@H](O[C@]14OC)C1=CC2=C(C=C13)OCO2

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InChI: InChI=1S/C23H27NO7/c1-12(25)5-13-8-21-9-16(26)20(27-3)23(28-4)22(21,24(13)2)10-19(31-23)14-6-17-18(7-15(14)21)30-11-29-17/h6-7,13,19-20H,5,8-11H2,1-4H3/t13-,19+,20+,21-,22-,23+/m0/s1

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InChIKey: SOMHCTSZFQAYCX-SWKHDPQKSA-N

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Source

Species Genus Family Order Class Phylum Kingdom Domain
Pericampylus glaucus Pericampylus Menispermaceae Ranunculales Magnoliopsida Streptophyta Viridiplantae Eukaryota

Properties Information

Molecule Weight: 429.4690000000002

TPSA？: 83.53000000000002

MolLogP？: 1.8806000000000005

Number of H-Donors: 0

Number of H-Acceptors: 8

RingCount: 6

Activities Information

Organism Target Name Standard Type Standard Value Standard Units doi
Hepatitis B virus Hepatitis B virus IC50 670000.0 nM 10.1021/np070479+
Hepatitis B virus Hepatitis B virus IC50 3010000.0 nM 10.1021/np070479+
Homo sapiens C8166 CC50 466000.0 nM 10.1021/np070479+
Human immunodeficiency virus 1 Human immunodeficiency virus 1 EC50 334100.0 nM 10.1021/np070479+
None ADMET CC50 2060000.0 nM 10.1021/np070479+
None Unchecked Ratio CC50/EC50 1.65 None 10.1021/np070479+
None Unchecked Ratio CC50/IC50 1.0 None 10.1021/np070479+
None Unchecked Ratio CC50/IC50 3.07 None 10.1021/np070479+

Metabolism Information