2-[(4R,5S,6S,7R,9R,10Z,12E,14S,16R)-6-[(2S,3R,4S,5S,6R)-4-(dimethylamino)-6-methyl-3,5-bis(oxidanyl)oxan-2-yl]oxy-5-methoxy-9,16-dimethyl-4,14-bis(oxidanyl)-2-oxidanylidene-1-oxacyclohexadeca-10,12-dien-7-yl]ethanal

Systemtic Name: 2-[(4R,5S,6S,7R,9R,10Z,12E,14S,16R)-6-[(2S,3R,4S,5S,6R)-4-(dimethylamino)-6-methyl-3,5-bis(oxidanyl)oxan-2-yl]oxy-5-methoxy-9,16-dimethyl-4,14-bis(oxidanyl)-2-oxidanylidene-1-oxacyclohexadeca-10,12-dien-7-yl]ethanal Openeye Name: 2-[(4R,5S,6S,7R,9R,10Z,12E,14S,16R)-6-[(2S,3R,4S,5S,6R)-4-(dimethylamino)-3,5-dihydroxy-6-methyl-tetrahydropyran-2-yl]oxy-4,14-dihydroxy-5-methoxy-9,16-dimethyl-2-oxo-1-oxacyclohexadeca-10,12-dien-7-yl]acetaldehyde CAS Name: 2-[(4R,5S,6S,7R,9R,10Z,12E,14S,16R)-6-[[(2S,3R,4S,5S,6R)-4-(dimethylamino)-3,5-dihydroxy-6-methyl-2-oxanyl]oxy]-4,14-dihydroxy-5-methoxy-9,16-dimethyl-2-oxo-1-oxacyclohexadeca-10,12-dien-7-yl]acetaldehyde IUPAC Name: 2-[(4R,5S,6S,7R,9R,10Z,12E,14S,16R)-6-[(2S,3R,4S,5S,6R)-4-(dimethylamino)-3,5-dihydroxy-6-methyloxan-2-yl]oxy-4,14-dihydroxy-5-methoxy-9,16-dimethyl-2-oxo-1-oxacyclohexadeca-10,12-dien-7-yl]acetaldehyde Traditional Name: 2-[(4R,5S,6S,7R,9R,10Z,12E,14S,16R)-6-[(2S,3R,4S,5S,6R)-4-(dimethylamino)-3,5-dihydroxy-6-methyl-tetrahydropyran-2-yl]oxy-4,14-dihydroxy-2-keto-5-methoxy-9,16-dimethyl-1-oxacyclohexadeca-10,12-dien-7-yl]acetaldehyde Formula: C28H47NO10 MolecularWeight: 557.67348

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CC1CC(C(C(C(CC(=O)OC(CC(C=CC=C1)O)C)O)OC)OC2C(C(C(C(O2)C)O)N(C)C)O)CC=O

Isomeric SMILES

C[C@@H]/1C[C@@H]([C@@H]([C@H]([C@@H](CC(=O)O[C@@H](C[C@@H](/C=C/C=C1)O)C)O)OC)O[C@H]2[C@@H]([C@H]([C@@H]([C@H](O2)C)O)N(C)C)O)CC=O

InChI

InChI=1S/C28H47NO10/c1-16-9-7-8-10-20(31)14-17(2)37-22(33)15-21(32)27(36-6)26(19(13-16)11-12-30)39-28-25(35)23(29(4)5)24(34)18(3)38-28/h7-10,12,16-21,23-28,31-32,34-35H,11,13-15H2,1-6H3/b9-7-,10-8+/t16-,17+,18+,19-,20+,21+,23-,24+,25+,26-,27-,28-/m0/s1