Pyralomicin 1b

AlkaPlorer ID: AK079470

Synonym: 'Pyralomicin 1b', 'Antibiotic MI 178-34F18C2'

IUPAC Name: 2,8-dichloro-1-[(1R,4R,5R,6S)-5,6-dihydroxy-3-(hydroxymethyl)-4-methoxycyclohex-2-en-1-yl]-5-hydroxy-6-methylchromeno[2,3-b]pyrrol-4-one

Structure

SMILES: CO[C@@H]1C(CO)=C[C@@H](N2C(Cl)=CC3=C2OC2=C(Cl)C=C(C)C(O)=C2C3=O)[C@H](O)[C@H]1O

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InChI: InChI=1S/C20H19Cl2NO7/c1-7-3-10(21)19-13(14(7)25)15(26)9-5-12(22)23(20(9)30-19)11-4-8(6-24)18(29-2)17(28)16(11)27/h3-5,11,16-18,24-25,27-28H,6H2,1-2H3/t11-,16+,17-,18-/m1/s1

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InChIKey: MPBNDUAEVIPFQP-JZDMUPLMSA-N

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Properties Information

Molecule Weight: 456.2780000000001

TPSA: 125.29000000000002

MolLogP: 2.278720000000001

Number of H-Donors: 4

Number of H-Acceptors: 8

RingCount: 4

Activities Information

Organism Target Name Standard Type Standard Value Standard Units doi

Metabolism Information