Term: | Chromomycin A3-1 |
|
Accession: | CHEBI:213056
|
browse the term
|
Synonyms: | exact_synonym: | [(2R,3R,4R,6S)-6-[[6-[(2S,4R,5R,6R)-4-[(2S,4R,5R,6R)-4-[(2S,4S,5S,6S)-5-acetyloxy-4-hydroxy-4,6-dimethyloxan-2-yl]oxy-5-hydroxy-6-methyloxan-2-yl]oxy-5-hydroxy-6-methyloxan-2-yl]oxy-7-(3,4-dihydroxy-1-methoxy-2-oxopentyl)-4,10-dihydroxy-3-methyl-5-oxo-7,8-dihydro-6H-anthracen-2-yl]oxy]-4-hydroxy-2-methyloxan-3-yl] acetate |
| related_synonym: | Formula=C50H70O23; InChI=1S/C50H70O23/c1-18-30(70-33-14-29(54)46(22(5)66-33)68-24(7)52)13-27-11-26-12-28(47(63-10)45(61)40(56)19(2)51)48(44(60)38(26)43(59)37(27)39(18)55)73-35-16-31(41(57)21(4)65-35)71-34-15-32(42(58)20(3)64-34)72-36-17-50(9,62)49(23(6)67-36)69-25(8)53/h11,13,19-23,28-29,31-36,40-42,46-49,51,54-59,62H,12,14-17H2,1-10H3/t19?,20-,21-,22-,23+,28?,29-,31-,32-,33+,34+,35+,36+,40?,41-,42-,46+,47?,48?,49+,50+/m1/s1; InChIKey=URILEWKYNYRYFO-GUUYZEKRSA-N; SMILES=O=C1C2=C(O)C3=C(O)C(=C(O[C@@H]4O[C@@H]([C@H](OC(=O)C)[C@@H](C4)O)C)C=C3C=C2CC(C1O[C@@H]5O[C@@H]([C@@H](O)[C@@H](C5)O[C@@H]6O[C@@H]([C@@H](O)[C@@H](C6)O[C@@H]7O[C@H]([C@H](OC(=O)C)[C@](C7)(O)C)C)C)C)C(OC)C(=O)C(O)C(O)C)C |
| xref: | Chemspider:63002667 |
|
|