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name Structure Reference Source Properties Activities Metabolism

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

AlkaPlorer ID: AK427176

Synonym: None

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

Structure

SMILES: CCN1C[C@]2(COC)CC[C@@H](O)[C@]34C1[C@](O)([C@H](OC)[C@H]23)[C@@]1(O)C[C@@H](OC)[C@H]2C[C@@H]4[C@H]1[C@@H]2OC

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InChI: InChI=1S/C25H41NO7/c1-6-26-11-22(12-30-2)8-7-16(27)24-14-9-13-15(31-3)10-23(28,17(14)18(13)32-4)25(29,21(24)26)20(33-5)19(22)24/h13-21,27-29H,6-12H2,1-5H3/t13-,14-,15-,16-,17+,18-,19-,20-,21?,22+,23-,24+,25-/m1/s1

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InChIKey: JVBLTQQBEQQLEV-QSWCHXNUSA-N

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Source

Species Genus Family Order Class Phylum Kingdom Domain
Consolida oliveriana Consolida Ranunculaceae Ranunculales Magnoliopsida Streptophyta Viridiplantae Eukaryota

Properties Information

Molecule Weight: 467.6030000000002

TPSA？: 100.85000000000002

MolLogP？: 0.2710000000000028

Number of H-Donors: 3

Number of H-Acceptors: 8

RingCount: 6

Activities Information

Organism Target Name Standard Type Standard Value Standard Units doi

Metabolism Information