Cosmomycin B

AlkaPlorer ID: AK293119

Synonym: Rhodomycin Y, Rhodilunanencin B, γ-Rhodomycin RDRs, Retamycin E2, A 262B, Antibiotic A 262B 

IUPAC Name: 10-[4-(dimethylamino)-5-[4-hydroxy-5-(5-hydroxy-6-methyloxan-2-yl)oxy-6-methyloxan-2-yl]oxy-6-methyloxan-2-yl]oxy-9-ethyl-4,6,9,11-tetrahydroxy-8,10-dihydro-7H-tetracene-5,12-dione

Structure

SMILES: CCC1(O)CCC2=C(O)C3=C(C(=O)C4=CC=CC(O)=C4C3=O)C(O)=C2C1OC1CC(N(C)C)C(OC2CC(O)C(OC3CCC(O)C(C)O3)C(C)O2)C(C)O1

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InChI: InChI=1S/C40H53NO14/c1-7-40(49)14-13-21-30(36(48)32-31(34(21)46)35(47)29-20(33(32)45)9-8-10-24(29)43)39(40)55-27-15-22(41(5)6)37(18(3)51-27)54-28-16-25(44)38(19(4)52-28)53-26-12-11-23(42)17(2)50-26/h8-10,17-19,22-23,25-28,37-39,42-44,46,48-49H,7,11-16H2,1-6H3

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InChIKey: MYQIMJTUIOIEOX-UHFFFAOYSA-N

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Reference

PubChem CID: 12766292

COCONUT: CNP0177480.3

Properties Information

Molecule Weight: 771.8570000000003

TPSA: 214.14

MolLogP: 2.9410000000000016

Number of H-Donors: 6

Number of H-Acceptors: 15

RingCount: 7

Activities Information

Organism Target Name Standard Type Standard Value Standard Units doi

Metabolism Information