Nystatin; Nystatin A1, 28,29-Didehydro, 5-ketone 

AlkaPlorer ID: AK308294

Synonym: Mycoheptin, Micoheptin, Mycoheptin A2 

IUPAC Name: 33-(4-amino-3,5-dihydroxy-6-methyloxan-2-yl)oxy-1,3,4,7,11,17,37-heptahydroxy-15,16,18-trimethyl-9,13-dioxo-14,39-dioxabicyclo[33.3.1]nonatriaconta-19,21,23,25,27,29,31-heptaene-36-carboxylic acid

Structure

SMILES: CC1C=CC=CC=CC=CC=CC=CC=CC(OC2OC(C)C(O)C(N)C2O)CC2OC(O)(CC(O)C(O)CCC(O)CC(=O)CC(O)CC(=O)OC(C)C(C)C1O)CC(O)C2C(=O)O

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InChI: InChI=1S/C47H71NO17/c1-27-17-15-13-11-9-7-5-6-8-10-12-14-16-18-34(64-46-44(58)41(48)43(57)30(4)63-46)24-38-40(45(59)60)37(54)26-47(61,65-38)25-36(53)35(52)20-19-31(49)21-32(50)22-33(51)23-39(55)62-29(3)28(2)42(27)56/h5-18,27-31,33-38,40-44,46,49,51-54,56-58,61H,19-26,48H2,1-4H3,(H,59,60)

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InChIKey: GXLOOVOKGBOVIH-UHFFFAOYSA-N

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Reference

PubChem CID: 3058603

COCONUT: CNP0293850.2

Source

Properties Information

Molecule Weight: 922.0750000000004

TPSA: 316.45

MolLogP: 0.9199000000000046

Number of H-Donors: 11

Number of H-Acceptors: 17

RingCount: 3

Activities Information

Organism Target Name Standard Type Standard Value Standard Units doi

Metabolism Information