Pyralomicin 1c

AlkaPlorer ID: AK079514

Synonym: 'Pyralomicin 1c', '(-)-Pyralomicin 1c', 'Antibiotic MI 178-34F18B2'

IUPAC Name: 2,6-dichloro-5-hydroxy-8-methyl-1-[(1R,4R,5S,6S)-4,5,6-trihydroxy-3-(hydroxymethyl)cyclohex-2-en-1-yl]chromeno[2,3-b]pyrrol-4-one

Structure

SMILES: CC1=CC(Cl)=C(O)C2=C1OC1=C(C=C(Cl)N1[C@@H]1C=C(CO)[C@@H](O)[C@H](O)[C@H]1O)C2=O

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InChI: InChI=1S/C19H17Cl2NO7/c1-6-2-9(20)15(26)12-14(25)8-4-11(21)22(19(8)29-18(6)12)10-3-7(5-23)13(24)17(28)16(10)27/h2-4,10,13,16-17,23-24,26-28H,5H2,1H3/t10-,13-,16+,17+/m1/s1

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InChIKey: QZDFKKWMBPFPOS-WIINYEKRSA-N

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Properties Information

Molecule Weight: 442.25100000000015

TPSA: 136.29000000000002

MolLogP: 1.6246200000000008

Number of H-Donors: 5

Number of H-Acceptors: 8

RingCount: 4

Activities Information

Organism Target Name Standard Type Standard Value Standard Units doi

Metabolism Information