| SpectraBase Spectrum ID |
3CKoI6udYu |
| Name |
(7S,9S)-9-acetyl-7-[(2R,4S,5S,6S)-4-[[3,4-diketo-2-[[(3R,4R,5S,6R)-2,4,5-trihydroxy-6-methylol-tetrahydropyran-3-yl]amino]-1-cyclobutenyl]amino]-5-hydroxy-6-methyl-tetrahydropyran-2-yl]oxy-6,9,11-trihydroxy-4-methoxy-8,10-dihydro-7H-tetracene-5,12-quinone |
| Compound Number |
39 |
| Copyright |
Copyright © 2016-2024 W. Robien, Inst. of Org. Chem., Univ. of Vienna. All Rights Reserved. |
| Formula |
C37H40N2O17 |
| InChI |
InChI=1S/C37H40N2O17/c1-11-27(42)15(38-24-25(34(49)33(24)48)39-26-35(50)30(45)18(10-40)56-36(26)51)7-19(54-11)55-17-9-37(52,12(2)41)8-14-21(17)32(47)23-22(29(14)44)28(43)13-5-4-6-16(53-3)20(13)31(23)46/h4-6,11,15,17-19,26-27,30,35-36,38-40,42,44-45,47,50-52H,7-10H2,1-3H3/t11-,15-,17-,18+,19-,26+,27+,30+,35+,36?,37-/m0/s1 |
| InChIKey |
RHMXFMADQBEXMA-WTAPPOCISA-N |
| Literature Reference Author |
F.SZTARICSKAI,A.SUM,E.ROTH,I.F.PELYVAS,S.SANDOR,G.BATTA,P.HE
RCZEGH,J.REMENYI,Z.M |
| Literature Reference Citation |
J.ANTIBIOTICS,58,704(2005) |
| Literature Reference DOI |
10.1038/ja.2005.96 |
| Molecular Weight |
784.728 g/mol |
| Solvent |
DMSO-D6:CD3OD |
| Source File Reference |
UWMB441 |
![(7S,9S)-9-acetyl-7-[(2R,4S,5S,6S)-4-[[3,4-diketo-2-[[(3R,4R,5S,6R)-2,4,5-trihydroxy-6-methylol-tetrahydropyran-3-yl]amino]-1-cyclobutenyl]amino]-5-hydroxy-6-methyl-tetrahydropyran-2-yl]oxy-6,9,11-trihydroxy-4-methoxy-8,10-dihydro-7H-tetracene-5,12-quinone](/api/spectrum/3CKoI6udYu/structure.png?h=300&w=458 "(7S,9S)-9-acetyl-7-[(2R,4S,5S,6S)-4-[[3,4-diketo-2-[[(3R,4R,5S,6R)-2,4,5-trihydroxy-6-methylol-tetrahydropyran-3-yl]amino]-1-cyclobutenyl]amino]-5-hydroxy-6-methyl-tetrahydropyran-2-yl]oxy-6,9,11-trihydroxy-4-methoxy-8,10-dihydro-7H-tetracene-5,12-quinone")
