Pandamarilactonine C

AlkaPlorer ID: AK035506

Synonym: '', '(+)-Pandamarilactonine A', 'Pandamarilactonine D', 'Pandamarilactonine B', 'Pandamarilactonine A', '(+)-Pandamarilactonine C'

IUPAC Name: (5Z)-3-methyl-5-[4-[(2R)-2-[(2S)-4-methyl-5-oxo-2H-furan-2-yl]pyrrolidin-1-yl]butylidene]furan-2-one

Structure

SMILES: CC1=C/C(=C/CCCN2CCC[C@@H]2[C@@H]2C=C(C)C(=O)O2)OC1=O

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InChI: InChI=1S/C18H23NO4/c1-12-10-14(22-17(12)20)6-3-4-8-19-9-5-7-15(19)16-11-13(2)18(21)23-16/h6,10-11,15-16H,3-5,7-9H2,1-2H3/b14-6-/t15-,16+/m1/s1

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InChIKey: HSICZNIIIPFAAO-RWENTQQKSA-N

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Source

Properties Information

Molecule Weight: 317.3850000000001

TPSA: 55.84

MolLogP: 2.489700000000001

Number of H-Donors: 0

Number of H-Acceptors: 5

RingCount: 3

Activities Information

Organism Target Name Standard Type Standard Value Standard Units doi

Metabolism Information