lycotetrastine A

AlkaPlorer ID: AK177420

Synonym: None

IUPAC Name: (1R,2S,11R,12R,15S,16R,18R)-12-[(1S)-1-hydroxyethyl]-14,20-dioxa-6-azahexacyclo[16.2.1.01,6.02,10.02,16.011,15]henicos-9-en-13-one

Structure

SMILES: C[C@H](O)[C@@H]1C(=O)O[C@@H]2[C@H]1C1=CCCN3CCC[C@]14[C@H]2C[C@H]1CO[C@@]34C1

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InChI: InChI=1S/C20H27NO4/c1-11(22)15-16-13-4-2-6-21-7-3-5-19(13)14(17(16)25-18(15)23)8-12-9-20(19,21)24-10-12/h4,11-12,14-17,22H,2-3,5-10H2,1H3/t11-,12+,14-,15-,16-,17-,19+,20+/m0/s1

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InChIKey: JQYPNSFOJGBSOS-RJBBADODSA-N

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Properties Information

Molecule Weight: 345.4390000000001

TPSA: 59.0

MolLogP: 1.7035999999999991

Number of H-Donors: 1

Number of H-Acceptors: 5

RingCount: 6

Activities Information

Organism Target Name Standard Type Standard Value Standard Units doi

Metabolism Information