Adiposin 2

AlkaPlorer ID: AK283338

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

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

Structure

SMILES: OCC1=CC(NC2C(CO)OC(OC3C(CO)OC(OC4C(CO)OC(O)C(O)C4O)C(O)C3O)C(O)C2O)C(O)C(O)C1O

copy

InChI: InChI=1S/C25H43NO19/c27-2-6-1-7(13(32)15(34)12(6)31)26-11-8(3-28)42-24(19(38)14(11)33)45-22-10(5-30)43-25(20(39)17(22)36)44-21-9(4-29)41-23(40)18(37)16(21)35/h1,7-40H,2-5H2

copy

InChIKey: ILBCZTCSQXPTTI-UHFFFAOYSA-N

copy

Reference

PubChem CID: 14078901

COCONUT: CNP0420727.1

Properties Information

Molecule Weight: 661.6070000000005

TPSA: 341.40000000000003

MolLogP: -9.592100000000013

Number of H-Donors: 15

Number of H-Acceptors: 20

RingCount: 4

Activities Information

Organism Target Name Standard Type Standard Value Standard Units doi

Metabolism Information