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name Structure Reference Source Properties Activities Metabolism

(1R,13R,15R,18R)-9,15-dimethoxy-5,7-dioxa-12-azapentacyclo[10.5.2.0¹,¹³.0²,¹⁰.0⁴,⁸]nonadeca-2(10),3,8,16-tetraen-18-yl pyridine-3-carboxylate

AlkaPlorer ID: AK268296

Synonym: None

IUPAC Name: [(1R,13R,15R,18R)-9,15-dimethoxy-5,7-dioxa-12-azapentacyclo[10.5.2.01,13.02,10.04,8]nonadeca-2,4(8),9,16-tetraen-18-yl] pyridine-3-carboxylate

Structure

SMILES: COC1=C2CN3C[C@H](OC(=O)C4=CC=CN=C4)[C@]4(C=C[C@H](OC)C[C@@H]34)C2=CC2=C1OCO2

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InChI: InChI=1S/C24H24N2O6/c1-28-15-5-6-24-17-9-18-22(31-13-30-18)21(29-2)16(17)11-26(19(24)8-15)12-20(24)32-23(27)14-4-3-7-25-10-14/h3-7,9-10,15,19-20H,8,11-13H2,1-2H3/t15-,19+,20-,24+/m0/s1

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InChIKey: IITMLRSQGPFGSO-RXYORGTDSA-N

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Source

Species Genus Family Order Class Phylum Kingdom Domain
Nerine bowdenii Nerine Amaryllidaceae Asparagales Magnoliopsida Streptophyta Viridiplantae Eukaryota

Properties Information

Molecule Weight: 436.4640000000003

TPSA？: 79.35000000000001

MolLogP？: 2.455000000000001

Number of H-Donors: 0

Number of H-Acceptors: 8

RingCount: 6

Activities Information

Organism Target Name Standard Type Standard Value Standard Units doi

Metabolism Information