[(2R,3S,4R,6R)-6-[10-[(2R,4S,5S,6S)-4-(dimethylazaniumyl)-4,6-dimethyl-5-oxidanyl-oxan-2-yl]-5-methyl-2-[(2R,3S)-2-methyl-3-[(2R,3S)-3-methyloxiran-2-yl]oxiran-2-yl]-11-oxidanyl-4,7,12-tris(oxidanylidene)naphtho[7,6-h]chromen-8-yl]-2-methyl-3-oxidanyl-oxan-4-yl]-dimethyl-azanium

Systemtic Name: [(2R,3S,4R,6R)-6-[10-[(2R,4S,5S,6S)-4-(dimethylazaniumyl)-4,6-dimethyl-5-oxidanyl-oxan-2-yl]-5-methyl-2-[(2R,3S)-2-methyl-3-[(2R,3S)-3-methyloxiran-2-yl]oxiran-2-yl]-11-oxidanyl-4,7,12-tris(oxidanylidene)naphtho[7,6-h]chromen-8-yl]-2-methyl-3-oxidanyl-oxan-4-yl]-dimethyl-azanium Openeye Name: [(2R,3S,4R,6R)-6-[10-[(2R,4S,5S,6S)-4-(dimethylammonio)-5-hydroxy-4,6-dimethyl-tetrahydropyran-2-yl]-11-hydroxy-5-methyl-2-[(2R,3S)-2-methyl-3-[(2R,3S)-3-methyloxiran-2-yl]oxiran-2-yl]-4,7,12-trioxo-naphtho[7,6-h]chromen-8-yl]-3-hydroxy-2-methyl-tetrahydropyran-4-yl]-dimethyl-ammonium CAS Name: [(2R,3S,4R,6R)-6-[10-[(2R,4S,5S,6S)-4-(dimethylammonio)-5-hydroxy-4,6-dimethyl-2-oxanyl]-11-hydroxy-5-methyl-2-[(2R,3S)-2-methyl-3-[(2R,3S)-3-methyl-2-oxiranyl]-2-oxiranyl]-4,7,12-trioxo-8-naphtho[7,6-h][1]benzopyranyl]-3-hydroxy-2-methyl-4-oxanyl]-dimethylammonium IUPAC Name: [(2R,3S,4R,6R)-6-[10-[(2R,4S,5S,6S)-4-(dimethylazaniumyl)-5-hydroxy-4,6-dimethyloxan-2-yl]-11-hydroxy-5-methyl-2-[(2R,3S)-2-methyl-3-[(2R,3S)-3-methyloxiran-2-yl]oxiran-2-yl]-4,7,12-trioxonaphtho[7,6-h]chromen-8-yl]-3-hydroxy-2-methyloxan-4-yl]-dimethylazanium Traditional Name: [(2R,3S,4R,6R)-6-[10-[(2R,4S,5S,6S)-4-(dimethylammonio)-5-hydroxy-4,6-dimethyl-tetrahydropyran-2-yl]-11-hydroxy-4,7,12-triketo-5-methyl-2-[(2R,3S)-2-methyl-3-[(2R,3S)-3-methyloxiran-2-yl]oxiran-2-yl]naphtho[7,6-h]chromen-8-yl]-3-hydroxy-2-methyl-tetrahydropyran-4-yl]-dimethyl-ammonium Formula: C41H52N2O11+2 MolecularWeight: 748.85838

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Descriptors Computed from Structure

Canonical SMILES:

CC1C(C(CC(O1)C2=CC(=C(C3=C2C(=O)C4=CC(=C5C(=O)C=C(OC5=C4C3=O)C6(C(O6)C7C(O7)C)C)C)O)C8CC(C(C(O8)C)O)(C)[NH+](C)C)[NH+](C)C)O

Isomeric SMILES

C[C@@H]1[C@H]([C@@H](C[C@@H](O1)C2=CC(=C(C3=C2C(=O)C4=CC(=C5C(=O)C=C(OC5=C4C3=O)[C@]6([C@@H](O6)[C@H]7[C@@H](O7)C)C)C)O)[C@H]8C[C@]([C@@H]([C@@H](O8)C)O)(C)[NH+](C)C)[NH+](C)C)O

InChI

InChI=1S/C41H50N2O11/c1-16-11-22-30(37-28(16)24(44)14-27(53-37)41(6)39(54-41)36-18(3)52-36)35(48)31-29(34(22)47)20(25-13-23(42(7)8)32(45)17(2)50-25)12-21(33(31)46)26-15-40(5,43(9)10)38(49)19(4)51-26/h11-12,14,17-19,23,25-26,32,36,38-39,45-46,49H,13,15H2,1-10H3/p+2/t17-,18+,19+,23-,25-,26-,32-,36-,38-,39+,40+,41+/m1/s1