Adiposin 1

AlkaPlorer ID: AK283337

Synonym: TAI-2, TAI-B, Antibiotic A2396 1-0, A2396 1-0

IUPAC Name: 5-[3,4-dihydroxy-6-(hydroxymethyl)-5-[[4,5,6-trihydroxy-3-(hydroxymethyl)cyclohex-2-en-1-yl]amino]oxan-2-yl]oxy-6-(hydroxymethyl)oxane-2,3,4-triol

Structure

SMILES: OCC1=CC(NC2C(CO)OC(OC3C(CO)OC(O)C(O)C3O)C(O)C2O)C(O)C(O)C1O

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InChI: InChI=1S/C19H33NO14/c21-2-5-1-6(11(25)13(27)10(5)24)20-9-7(3-22)33-19(16(30)12(9)26)34-17-8(4-23)32-18(31)15(29)14(17)28/h1,6-31H,2-4H2

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InChIKey: ZHHCAFYQXLRVEA-UHFFFAOYSA-N

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Reference

PubChem CID: 163048501

COCONUT: CNP0331330.1

Properties Information

Molecule Weight: 499.46600000000007

TPSA: 262.24999999999994

MolLogP: -7.416299999999989

Number of H-Donors: 12

Number of H-Acceptors: 15

RingCount: 3

Activities Information

Organism Target Name Standard Type Standard Value Standard Units doi

Metabolism Information