Compound ID | 3139

Update compound information

Setomimycin

Synonym(s): Antibiotic AM 2947

Class: Natural product antibiotic

Spectrum of activity: Gram-positive
Details of activity: Active against Staphylococcus aureus and Mycobacterium smegmatis; likely DNA synthesis inhibitor
Description: Natural product from Streptomyces pseudovenezuelae; 9,9'-bianthrylanthracene scaffold; shows anti-Sarcoma ascites tumour activity
Year first mentioned: 1978
Development status: Experimental
Chemical structure(s):
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Molecular weight: 580.58
Iso. SMILES: CC1=CC(=O)C2=C(C3=C(C=CC=C3O)C(=C2C1C(=O)C)C4=C5C(C(CC(=O)C5=C(C6=C4C=CC=C6O)O)(C)O)C(=O)C)O
InChI Key: BIEJOJJMQZEKED-UHFFFAOYSA-N
Can. SMILES: CC1=CC(=O)C2=C(C3=C(C=CC=C3C(=C2C1C(=O)C)C4=C5C(=C(C6=C(C=CC=C64)O)O)C(=O)CC(C)(C5C(=O)C)O)O)O
InChI: InChI=1S/C34H28O9/c1-13-11-20(39)27-29(22(13)14(2)35)25(16-7-5-9-18(37)23(16)32(27)41)26-17-8-6-10-19(38)24(17)33(42)28-21(40)12-34(4,43)31(15(3)36)30(26)28/h5-11,22,31,37-38,41-43H,12H2,1-4H3
External links:
PubChem link: https://pubchem.ncbi.nlm.nih.gov/compound/198523
Citation: https://www.jstage.jst.go.jp/article/antibiotics1968/31/11/31_11_1091/_article/-char/en

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