Heneicomycin

Catalog Number

ACM66170374

Product Name

Heneicomycin

Structure

CAS

66170-37-4

Category

Heterocyclic Organic Compound

Synonyms

Heneicomycin, Antibiotic A 21A, 30-Deoxy-1-methylmocimycin, A21A, Mocimycin, 30-deoxy-1-methyl-, CID6450348, 2H-Pyran-2-acetamide, N-((2E,4E,6S,7R)-7-((2S,3S,4R,5R)-5-((1E,3E,5E)-7-(1,2-dihydro-4-hydroxy-1-methyl-2-oxo-3-pyridinyl)-6-methyl-7-oxo-1,3,5-heptatrienyl)tetrahydro-3,4-dihydroxy-2-furanyl)-6-methoxy-5-methyl-2,4-octadienyl)-alpha-ethyltetrahydro-2,4-dihydroxy-5,5-dimethyl-6-((1E,3Z)-1,3-pentadienyl)-, (alphaS,2S,4S,6S)-, 2H-Pyran-2-acetamide, N-(7-(5-(7-(1,2-dihydro-4-hydroxy-1-methyl-2-oxo-3-pyridinyl)-6-methyl-7-oxo-1,3,5-heptatrienyl)tetrahydro-3,4-dihydroxy-2-furanyl)-6-methoxy-5-methyl-2,4-octadienyl)-alpha-ethyltetrahydro-2,4-dihydroxy-5,5-dimethyl-6-(1,3-pentadienyl)-, (2S-(2alpha,2(R*(2E,4E,6R*,7S*(2R*,3R*,4S*,5S*(1E,3E,5E)))),4beta,6beta(1E,3E)))-, 66170-37-4

IUPAC Name

(2S)-2-[(2S,4S,6S)-2,4-dihydroxy-5,5-dimethyl-6-[(1E,3E)-penta-1,3-dienyl]oxan-2-yl]-N-[(2E,4E,6S,7R)-7-[(2S,3S,4R,5R)-3,4-dihydroxy-5-[(1E,3E,5E)-7-(2-hydroxy-1-methyl-4-oxopyridin-3-yl)-6-methyl-7-oxohepta-1,3,5-trienyl]oxolan-2-yl]-6-methoxy-5-methyloc

Molecular Weight

794.969880 [g/mol]

Molecular Formula

C₄₄H₆₂N₂O₁₁

Canonical SMILES

CCC(C(=O)NCC=CC=C(C)C(C(C)C1C(C(C(O1)C=CC=CC=C(C)C(=C2C(=O)C=CN(C2=O)C)O)O)O)OC)C3(CC(C(C(O3)C=CC=CC)(C)C)O)O

InChI Key

KTVMODYFJKQMSD-ZODLGNRVSA-N

H-Bond Acceptor

12

H-Bond Donor

6

MSDS

COA

Spec Sheet