Consorientaline

AlkaPlorer ID: AK010249

Synonym: '(-)-Consorientaline'

IUPAC Name: 2-[(1S,2S,4S,6R,7R,8R,10R,11R)-6,8-dihydroxy-4,7,11-trimethyl-5-methylidene-13-azatetracyclo[9.3.3.01,10.02,7]heptadecan-13-yl]acetaldehyde

Structure

SMILES: C=C1[C@@H](O)[C@@]2(C)[C@H](O)C[C@@H]3[C@@]4(C)CCC[C@@]3(CN(CC=O)C4)[C@@H]2C[C@@H]1C

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InChI: InChI=1S/C22H35NO3/c1-14-10-17-21(4,19(26)15(14)2)18(25)11-16-20(3)6-5-7-22(16,17)13-23(12-20)8-9-24/h9,14,16-19,25-26H,2,5-8,10-13H2,1,3-4H3/t14-,16+,17+,18+,19+,20-,21+,22-/m0/s1

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InChIKey: VFRHLKNINNUPQV-IUCVIKEYSA-N

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Source

Properties Information

Molecule Weight: 361.5260000000001

TPSA: 60.77

MolLogP: 2.637700000000001

Number of H-Donors: 2

Number of H-Acceptors: 4

RingCount: 4

Activities Information

Organism Target Name Standard Type Standard Value Standard Units doi

Metabolism Information