Rubomycin F

AlkaPlorer ID: AK021475

Synonym: None

IUPAC Name: ethyl N-[6-[[(1S,3S)-3-acetyl-3,5,12-trihydroxy-10-methoxy-6,11-dioxo-2,4-dihydro-1H-tetracen-1-yl]oxy]-3-hydroxy-2-methyloxan-4-yl]carbamate

Structure

SMILES: CCOC(=O)NC1CC(O[C@H]2C[C@](O)(C(C)=O)CC3=C(O)C4=C(C(=O)C5=C(OC)C=CC=C5C4=O)C(O)=C32)OC(C)C1O

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InChI: InChI=1S/C30H33NO12/c1-5-41-29(38)31-16-9-19(42-12(2)24(16)33)43-18-11-30(39,13(3)32)10-15-21(18)28(37)23-22(26(15)35)25(34)14-7-6-8-17(40-4)20(14)27(23)36/h6-8,12,16,18-19,24,33,35,37,39H,5,9-11H2,1-4H3,(H,31,38)/t12?,16?,18-,19?,24?,30-/m0/s1

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InChIKey: YMPKVNDJETUUPT-ILJARRERSA-N

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Properties Information

Molecule Weight: 599.5890000000004

TPSA: 198.15

MolLogP: 1.8163

Number of H-Donors: 5

Number of H-Acceptors: 12

RingCount: 5

Activities Information

Organism Target Name Standard Type Standard Value Standard Units doi

Metabolism Information