(7S,9R,10R)-7-[(2R,4S,5S,6S)-4-(dimethylamino)-6-methyl-5-[(2S,4S,5S,6S)-6-methyl-5-[(2S,4S,5S,6S)-6-methyl-4,5-bis(oxidanyl)oxan-2-yl]oxy-4-oxidanyl-oxan-2-yl]oxy-oxan-2-yl]oxy-10-[(2R,4R,5R,6R)-4-(dimethylamino)-6-methyl-5-[(2R,4R,5R,6R)-6-methyl-5-[(2R,4R,5R,6R)-6-methyl-4,5-bis(oxidanyl)oxan-2-yl]oxy-4-oxidanyl-oxan-2-yl]oxy-oxan-2-yl]oxy-9-ethyl-1,4,6,9,11-pentakis(oxidanyl)-8,10-dihydro-7H-tetracene-5,12-dione; (7S,9R,10R)-7-[(2R,4S,5S,6S)-4-(dimethylamino)-6-methyl-5-[(2S,4S,5S,6S)-6-methyl-5-[(2S,4S

Systemtic Name: (7S,9R,10R)-7-[(2R,4S,5S,6S)-4-(dimethylamino)-6-methyl-5-[(2S,4S,5S,6S)-6-methyl-5-[(2S,4S,5S,6S)-6-methyl-4,5-bis(oxidanyl)oxan-2-yl]oxy-4-oxidanyl-oxan-2-yl]oxy-oxan-2-yl]oxy-10-[(2R,4R,5R,6R)-4-(dimethylamino)-6-methyl-5-[(2R,4R,5R,6R)-6-methyl-5-[(2R,4R,5R,6R)-6-methyl-4,5-bis(oxidanyl)oxan-2-yl]oxy-4-oxidanyl-oxan-2-yl]oxy-oxan-2-yl]oxy-9-ethyl-1,4,6,9,11-pentakis(oxidanyl)-8,10-dihydro-7H-tetracene-5,12-dione; (7S,9R,10R)-7-[(2R,4S,5S,6S)-4-(dimethylamino)-6-methyl-5-[(2S,4S,5S,6S)-6-methyl-5-[(2S,4S Openeye Name: (7S,9R,10R)-7-[(2R,4S,5S,6S)-5-[(2S,4S,5S,6S)-5-[(2S,4S,5S,6S)-4,5-dihydroxy-6-methyl-tetrahydropyran-2-yl]oxy-4-hydroxy-6-methyl-tetrahydropyran-2-yl]oxy-4-(dimethylamino)-6-methyl-tetrahydropyran-2-yl]oxy-10-[(2R,4R,5R,6R)-5-[(2R,4R,5R,6R)-5-[(2R,4R,5R,6R)-4,5-dihydroxy-6-methyl-tetrahydropyran-2-yl]oxy-4-hydroxy-6-methyl-tetrahydropyran-2-yl]oxy-4-(dimethylamino)-6-methyl-tetrahydropyran-2-yl]oxy-9-ethyl-1,4,6,9,11-pentahydroxy-8,10-dihydro-7H-tetracene-5,12-dione; (7S,9R,10R)-7-[(2R,4S,5S,6S)-5-[(2S,4S, CAS Name: (7S,9R,10R)-7-[[(2R,4S,5S,6S)-5-[[(2S,4S,5S,6S)-5-[[(2S,4S,5S,6S)-4,5-dihydroxy-6-methyl-2-oxanyl]oxy]-4-hydroxy-6-methyl-2-oxanyl]oxy]-4-(dimethylamino)-6-methyl-2-oxanyl]oxy]-10-[[(2R,4R,5R,6R)-5-[[(2R,4R,5R,6R)-5-[[(2R,4R,5R,6R)-4,5-dihydroxy-6-methyl-2-oxanyl]oxy]-4-hydroxy-6-methyl-2-oxanyl]oxy]-4-(dimethylamino)-6-methyl-2-oxanyl]oxy]-9-ethyl-1,4,6,9,11-pentahydroxy-8,10-dihydro-7H-tetracene-5,12-dione; (7S,9R,10R)-7-[[(2R,4S,5S,6S)-5-[[(2S,4S,5S,6S)-5-[[(2S,4S,5S,6S)-4,5-dihydroxy-6-methyl-2-oxanyl]o IUPAC Name: (7S,9R,10R)-7-[(2R,4S,5S,6S)-5-[(2S,4S,5S,6S)-5-[(2S,4S,5S,6S)-4,5-dihydroxy-6-methyloxan-2-yl]oxy-4-hydroxy-6-methyloxan-2-yl]oxy-4-(dimethylamino)-6-methyloxan-2-yl]oxy-10-[(2R,4R,5R,6R)-5-[(2R,4R,5R,6R)-5-[(2R,4R,5R,6R)-4,5-dihydroxy-6-methyloxan-2-yl]oxy-4-hydroxy-6-methyloxan-2-yl]oxy-4-(dimethylamino)-6-methyloxan-2-yl]oxy-9-ethyl-1,4,6,9,11-pentahydroxy-8,10-dihydro-7H-tetracene-5,12-dione; (7S,9R,10R)-7-[(2R,4S,5S,6S)-5-[(2S,4S,5S,6S)-5-[(2S,4S,5S,6S)-4,5-dihydroxy-6-methyloxan-2-yl]oxy-4-hydroxy-6- Traditional Name: (7S,9R,10R)-7-[(2R,4S,5S,6S)-5-[(2S,4S,5S,6S)-5-[(2S,4S,5S,6S)-4,5-dihydroxy-6-methyl-tetrahydropyran-2-yl]oxy-4-hydroxy-6-methyl-tetrahydropyran-2-yl]oxy-4-(dimethylamino)-6-methyl-tetrahydropyran-2-yl]oxy-10-[(2R,4R,5R,6R)-5-[(2R,4R,5R,6R)-5-[(2R,4R,5R,6R)-4,5-dihydroxy-6-methyl-tetrahydropyran-2-yl]oxy-4-hydroxy-6-methyl-tetrahydropyran-2-yl]oxy-4-(dimethylamino)-6-methyl-tetrahydropyran-2-yl]oxy-9-ethyl-1,4,6,9,11-pentahydroxy-8,10-dihydro-7H-tetracene-5,12-quinone; (7S,9R,10R)-7-[(2R,4S,5S,6S)-5-[(2S,4 Formula: C120H176N4O49 MolecularWeight: 2458.67884

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Descriptors Computed from Structure

Canonical SMILES:

CCC1(CC(C2=C(C3=C(C(=C2C1OC4CC(C(C(O4)C)OC5CC(C(C(O5)C)OC6CC(C(C(O6)C)O)O)O)N(C)C)O)C(=O)C7=C(C3=O)C(=CC=C7)O)O)OC8CC(C(C(O8)C)OC9CC(C(C(O9)C)OC1CC(C(C(O1)C)O)O)O)N(C)C)O.CCC1(CC(C2=C(C3=C(C(=C2C1OC4CC(C(C(O4)C)OC5CC(C(C(O5)C)OC6CC(C(C(O6)C)O)O)O)N(C)C)O)C(=O)C7=C(C=CC(=C7C3=O)O)O)O)OC8CC(C(C(O8)C)OC9CC(C(C(O9)C)OC1CC(C(C(O1)C)O)O)O)N(C)C)O

Isomeric SMILES

CC[C@]1(C[C@@H](C2=C(C3=C(C(=C2[C@H]1O[C@@H]4C[C@H]([C@H]([C@H](O4)C)O[C@@H]5C[C@H]([C@H]([C@H](O5)C)O[C@@H]6C[C@H]([C@H]([C@H](O6)C)O)O)O)N(C)C)O)C(=O)C7=C(C3=O)C(=CC=C7)O)O)O[C@H]8C[C@@H]([C@@H]([C@@H](O8)C)O[C@H]9C[C@@H]([C@@H]([C@@H](O9)C)O[C@H]1C[C@@H]([C@@H]([C@@H](O1)C)O)O)O)N(C)C)O.CC[C@]1(C[C@@H](C2=C(C3=C(C(=C2[C@H]1O[C@@H]4C[C@H]([C@H]([C@H](O4)C)O[C@@H]5C[C@H]([C@H]([C@H](O5)C)O[C@@H]6C[C@H]([C@H]([C@H](O6)C)O)O)O)N(C)C)O)C(=O)C7=C(C=CC(=C7C3=O)O)O)O)O[C@H]8C[C@@H]([C@@H]([C@@H](O8)C)O[C@H]9C[C@@H]([C@@H]([C@@H](O9)C)O[C@H]1C[C@@H]([C@@H]([C@@H](O1)C)O)O)O)N(C)C)O

InChI

InChI=1S/C60H88N2O25.C60H88N2O24/c1-12-60(75)21-36(82-37-15-28(61(8)9)55(24(4)78-37)83-41-19-34(67)57(26(6)80-41)85-39-17-32(65)49(69)22(2)76-39)45-48(54(74)47-46(53(45)73)51(71)43-30(63)13-14-31(64)44(43)52(47)72)59(60)87-38-16-29(62(10)11)56(25(5)79-38)84-42-20-35(68)58(27(7)81-42)86-40-18-33(66)50(70)23(3)77-40;1-12-60(74)22-37(81-38-16-30(61(8)9)55(25(4)77-38)82-42-20-35(66)57(27(6)79-42)84-40-18-33(64)49(68)23(2)75-40)45-48(54(73)46-47(53(45)72)52(71)44-29(51(46)70)14-13-15-32(44)63)59(60)86-39-17-31(62(10)11)56(26(5)78-39)83-43-21-36(67)58(28(7)80-43)85-41-19-34(65)50(69)24(3)76-41/h13-14,22-29,32-42,49-50,55-59,63-70,73-75H,12,15-21H2,1-11H3;13-15,23-28,30-31,33-43,49-50,55-59,63-69,72-74H,12,16-22H2,1-11H3/t22-,23+,24-,25+,26-,27+,28-,29+,32-,33+,34-,35+,36-,37-,38+,39-,40+,41-,42+,49+,50-,55+,56-,57+,58-,59+,60+;23-,24+,25-,26+,27-,28+,30-,31+,33-,34+,35-,36+,37-,38-,39+,40-,41+,42-,43+,49+,50-,55+,56-,57+,58-,59+,60+/m00/s1