Chaunolidine A

AlkaPlorer ID: AK031625

Synonym: 'Chaunolidine A', 'Tolypocladenol B'

IUPAC Name: (3Z,5S)-3-[(2S,4S)-1-hydroxy-2,4-dimethyloct-6-enylidene]-5-[(S)-hydroxy-(4-hydroxyphenyl)methyl]pyrrolidine-2,4-dione

Structure

SMILES: CC=CC[C@H](C)C[C@H](C)/C(O)=C1\C(=O)[C@H]([C@@H](O)C2=CC=C(O)C=C2)N=C1O

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InChI: InChI=1S/C21H27NO5/c1-4-5-6-12(2)11-13(3)18(24)16-20(26)17(22-21(16)27)19(25)14-7-9-15(23)10-8-14/h4-5,7-10,12-13,17,19,23-25H,6,11H2,1-3H3,(H,22,27)/b5-4?,18-16-/t12-,13-,17-,19-/m0/s1

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InChIKey: IWIISBMWNKBQQH-HJNJOKSFSA-N

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Properties Information

Molecule Weight: 373.44900000000007

TPSA: 110.35

MolLogP: 3.774000000000002

Number of H-Donors: 4

Number of H-Acceptors: 5

RingCount: 2

Activities Information

Organism Target Name Standard Type Standard Value Standard Units doi

Metabolism Information