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name Structure Reference Source Properties Activities Metabolism

(1S,2R,3R,4S,5R,6S,8R,9R,10R,13S,16S,17R,18S)-11-ethyl-4,6,16,18-tetramethoxy-11-azahexacyclo[7.7.2.1²,⁵.0¹,¹⁰.0³,⁸.0¹³,¹⁷]nonadecane-8,13-diol

AlkaPlorer ID: AK054145

Synonym: None

IUPAC Name: (1S,2R,3R,4S,5R,6S,8R,9R,10R,13S,16S,17R,18S)-11-ethyl-4,6,16,18-tetramethoxy-11-azahexacyclo[7.7.2.12,5.01,10.03,8.013,17]nonadecane-8,13-diol

Structure

SMILES: CCN1C[C@]2(O)CC[C@H](OC)[C@@]34[C@@H]5C[C@H]6[C@H](OC)[C@@H]5[C@](O)(C[C@@H]6OC)[C@@H]([C@@H](OC)[C@H]23)[C@@H]14

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InChI: InChI=1S/C24H39NO6/c1-6-25-11-22(26)8-7-15(29-3)24-13-9-12-14(28-2)10-23(27,16(13)18(12)30-4)17(21(24)25)19(31-5)20(22)24/h12-21,26-27H,6-11H2,1-5H3/t12-,13-,14+,15+,16-,17+,18+,19-,20-,21-,22-,23-,24+/m1/s1

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InChIKey: DEHXIDKRAGPUIB-HVAZYCNGSA-N

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Source

Species Genus Family Order Class Phylum Kingdom Domain
Aconitum kirinense Aconitum Ranunculaceae Ranunculales Magnoliopsida Streptophyta Viridiplantae Eukaryota

Properties Information

Molecule Weight: 437.57700000000017

TPSA？: 80.62000000000002

MolLogP？: 0.908500000000002

Number of H-Donors: 2

Number of H-Acceptors: 7

RingCount: 6

Activities Information

Organism Target Name Standard Type Standard Value Standard Units doi

Metabolism Information