Cladosin A (minor tautomer)

AlkaPlorer ID: AK092059

Synonym: None

IUPAC Name: 4-hydroxy-3-[(3R,5S)-5-hydroxy-3-methoxyhexanimidoyl]-5-propan-2-ylidenepyrrol-2-one

Structure

SMILES: CO[C@H](C/C(N)=C1/C(=O)C(=C(C)C)N=C1O)C[C@H](C)O

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InChI: InChI=1S/C14H22N2O4/c1-7(2)12-13(18)11(14(19)16-12)10(15)6-9(20-4)5-8(3)17/h8-9,17H,5-6,15H2,1-4H3,(H,16,19)/b11-10+/t8-,9-/m0/s1

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InChIKey: DZWYYNFJNGGDEG-IYORNCFKSA-N

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Properties Information

Molecule Weight: 282.34000000000003

TPSA: 105.14

MolLogP: 1.2083

Number of H-Donors: 3

Number of H-Acceptors: 5

RingCount: 1

Activities Information

Organism Target Name Standard Type Standard Value Standard Units doi

Metabolism Information