Antibiotic A 503083F; Me ester

AlkaPlorer ID: AK288242

Synonym: Antibiotic A 503083E, A 503083E

IUPAC Name: methyl 2-[2-amino-1-[4-carbamoyloxy-5-(2,4-dioxopyrimidin-1-yl)-3-methoxyoxolan-2-yl]-2-oxoethoxy]-3,4-dihydroxy-3,4-dihydro-2H-pyran-6-carboxylate

Structure

SMILES: COC(=O)C1=CC(O)C(O)C(OC(C(=N)O)C2OC(N3C=CC(O)=NC3=O)C(OC(=N)O)C2OC)O1

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InChI: InChI=1S/C19H24N4O13/c1-31-10-11(34-15(13(10)36-18(21)29)23-4-3-8(25)22-19(23)30)12(14(20)27)35-17-9(26)6(24)5-7(33-17)16(28)32-2/h3-6,9-13,15,17,24,26H,1-2H3,(H2,20,27)(H2,21,29)(H,22,25,30)

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InChIKey: YPTJPYWKFYBXSN-UHFFFAOYSA-N

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Properties Information

Molecule Weight: 516.4160000000002

TPSA: 256.19

MolLogP: -2.2052599999999947

Number of H-Donors: 7

Number of H-Acceptors: 15

RingCount: 3

Activities Information

Organism Target Name Standard Type Standard Value Standard Units doi

Metabolism Information