(7S,9S)-9-ethanoyl-7-[(2R,3R,4R,5S,6S)-3-fluoranyl-5-methoxy-6-methyl-4-oxidanyl-oxan-2-yl]oxy-4-methoxy-6,9,11-tris(oxidanyl)-8,10-dihydro-7H-tetracene-5,12-dione

Systemtic Name: (7S,9S)-9-ethanoyl-7-[(2R,3R,4R,5S,6S)-3-fluoranyl-5-methoxy-6-methyl-4-oxidanyl-oxan-2-yl]oxy-4-methoxy-6,9,11-tris(oxidanyl)-8,10-dihydro-7H-tetracene-5,12-dione Openeye Name: (7S,9S)-9-acetyl-7-[(2R,3R,4R,5S,6S)-3-fluoro-4-hydroxy-5-methoxy-6-methyl-tetrahydropyran-2-yl]oxy-6,9,11-trihydroxy-4-methoxy-8,10-dihydro-7H-tetracene-5,12-dione CAS Name: (7S,9S)-9-acetyl-7-[[(2R,3R,4R,5S,6S)-3-fluoro-4-hydroxy-5-methoxy-6-methyl-2-oxanyl]oxy]-6,9,11-trihydroxy-4-methoxy-8,10-dihydro-7H-tetracene-5,12-dione IUPAC Name: (7S,9S)-9-acetyl-7-[(2R,3R,4R,5S,6S)-3-fluoro-4-hydroxy-5-methoxy-6-methyloxan-2-yl]oxy-6,9,11-trihydroxy-4-methoxy-8,10-dihydro-7H-tetracene-5,12-dione Traditional Name: (7S,9S)-9-acetyl-7-[(2R,3R,4R,5S,6S)-3-fluoro-4-hydroxy-5-methoxy-6-methyl-tetrahydropyran-2-yl]oxy-6,9,11-trihydroxy-4-methoxy-8,10-dihydro-7H-tetracene-5,12-quinone Formula: C28H29FO11 MolecularWeight: 560.521663

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Descriptors Computed from Structure

Canonical SMILES:

CC1C(C(C(C(O1)OC2CC(CC3=C(C4=C(C(=C23)O)C(=O)C5=C(C4=O)C=CC=C5OC)O)(C(=O)C)O)F)O)OC

Isomeric SMILES

C[C@H]1[C@H]([C@H]([C@H]([C@@H](O1)O[C@H]2C[C@@](CC3=C(C4=C(C(=C23)O)C(=O)C5=C(C4=O)C=CC=C5OC)O)(C(=O)C)O)F)O)OC

InChI

InChI=1S/C28H29FO11/c1-10-26(38-4)25(35)20(29)27(39-10)40-15-9-28(36,11(2)30)8-13-17(15)24(34)19-18(22(13)32)21(31)12-6-5-7-14(37-3)16(12)23(19)33/h5-7,10,15,20,25-27,32,34-36H,8-9H2,1-4H3/t10-,15-,20+,25-,26+,27-,28-/m0/s1