Serratinine

AlkaPlorer ID: AK000235

Synonym: None

IUPAC Name: (10S,11S)-10-hydroxy-11-methyl-13-oxido-13-azoniatetracyclo[7.7.0.01,13.04,9]hexadecan-7-one

Structure

SMILES: C[C@H]1C[N+]2(CCCC23CCC4C3([C@H]1O)CC(=O)CC4)[O-]

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InChI: InChI=1S/C16H25NO3/c1-11-10-17(20)8-2-6-15(17)7-5-12-3-4-13(18)9-16(12,15)14(11)19/h11-12,14,19H,2-10H2,1H3/t11-,12?,14-,15?,16?,17?/m0/s1

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InChIKey: GXXCLFHDZZGIQG-WHMXUPBTSA-N

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Source

Properties Information

Molecule Weight: 279.38

TPSA: 60.36

MolLogP: 1.9935999999999998

Number of H-Donors: 1

Number of H-Acceptors: 3

RingCount: 4

Activities Information

Organism Target Name Standard Type Standard Value Standard Units doi

Metabolism Information