Antimycin A (DMSO Solution)

Key facts

CAS number

1397-94-0

Form

Liquid

form

Molecular weight

548.6 Da

Molecular formula

C₂₈H₄₀N₂O₉

PubChem

14957

Nature

Synthetic

Biochemical name

Antimycin A

Biological description

Antibiotic. Induces apoptosis and inhibits mitochondrial electron transport specifically between cytochromes b and c1.

Canonical smiles

CCCCCCC1C(C(OC(=O)C(C(OC1=O)C)NC(=O)C2=C(C(=CC=C2)NC=O)O)C)OC(=O)CC(C)C

Isomeric smiles

CCCCCC[C@@H]1[C@H]([C@@H](OC(=O)[C@H]([C@H](OC1=O)C)NC(=O)C2=C(C(=CC=C2)NC=O)O)C)OC(=O)CC(C)C

InChi

InChI=1S/C28H40N2O9/c1-6-7-8-9-11-20-25(39-22(32)14-16(2)3)18(5)38-28(36)23(17(4)37-27(20)35)30-26(34)19-12-10-13-21(24(19)33)29-15-31/h10,12-13,15-18,20,23,25,33H,6-9,11,14H2,1-5H3,(H,29,31)(H,30,34)/t17-,18+,20-,23+,25+/m1/s1

InChiKey

UIFFUZWRFRDZJC-SBOOETFBSA-N

IUPAC Name

[(2R,3S,6S,7R,8R)-3-[(3-formamido-2-hydroxybenzoyl)amino]-8-hexyl-2,6-dimethyl-4,9-dioxo-1,5-dioxonan-7-yl] 3-methylbutanoate