(3R,4S,5S,6R,9R,10E,11R,12R,13S,14S)-6-[(2S,3R,4S,6R)-4-(dimethylamino)-6-methyl-3-oxidanyl-oxan-2-yl]oxy-14-ethyl-3,5,7,9,11,13-hexamethyl-4,7,12,13-tetrakis(oxidanyl)-10-(3-phenoxypropoxyimino)-1-oxacyclotetradecan-2-one

Systemtic Name: (3R,4S,5S,6R,9R,10E,11R,12R,13S,14S)-6-[(2S,3R,4S,6R)-4-(dimethylamino)-6-methyl-3-oxidanyl-oxan-2-yl]oxy-14-ethyl-3,5,7,9,11,13-hexamethyl-4,7,12,13-tetrakis(oxidanyl)-10-(3-phenoxypropoxyimino)-1-oxacyclotetradecan-2-one Openeye Name: (3R,4S,5S,6R,9R,10E,11R,12R,13S,14S)-6-[(2S,3R,4S,6R)-4-(dimethylamino)-3-hydroxy-6-methyl-tetrahydropyran-2-yl]oxy-14-ethyl-4,7,12,13-tetrahydroxy-3,5,7,9,11,13-hexamethyl-10-(3-phenoxypropoxyimino)-oxacyclotetradecan-2-one CAS Name: (3R,4S,5S,6R,9R,10E,11R,12R,13S,14S)-6-[[(2S,3R,4S,6R)-4-(dimethylamino)-3-hydroxy-6-methyl-2-oxanyl]oxy]-14-ethyl-4,7,12,13-tetrahydroxy-3,5,7,9,11,13-hexamethyl-10-(3-phenoxypropoxyimino)-oxacyclotetradecan-2-one IUPAC Name: (3R,4S,5S,6R,9R,10E,11R,12R,13S,14S)-6-[(2S,3R,4S,6R)-4-(dimethylamino)-3-hydroxy-6-methyloxan-2-yl]oxy-14-ethyl-4,7,12,13-tetrahydroxy-3,5,7,9,11,13-hexamethyl-10-(3-phenoxypropoxyimino)-oxacyclotetradecan-2-one Traditional Name: (3R,4S,5S,6R,9R,10E,11R,12R,13S,14S)-6-[(2S,3R,4S,6R)-4-(dimethylamino)-3-hydroxy-6-methyl-tetrahydropyran-2-yl]oxy-14-ethyl-4,7,12,13-tetrahydroxy-3,5,7,9,11,13-hexamethyl-10-(3-phenoxypropyloximino)-oxacyclotetradecan-2-one Formula: C38H64N2O11 MolecularWeight: 724.92156

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Descriptors Computed from Structure

Canonical SMILES:

CCC1C(C(C(C(=NOCCCOC2=CC=CC=C2)C(CC(C(C(C(C(C(=O)O1)C)O)C)OC3C(C(CC(O3)C)N(C)C)O)(C)O)C)C)O)(C)O

Isomeric SMILES

CC[C@H]1[C@@]([C@@H]([C@@H](/C(=N/OCCCOC2=CC=CC=C2)/[C@@H](CC([C@@H]([C@H]([C@@H]([C@H](C(=O)O1)C)O)C)O[C@H]3[C@@H]([C@H](C[C@H](O3)C)N(C)C)O)(C)O)C)C)O)(C)O

InChI

InChI=1S/C38H64N2O11/c1-11-29-38(8,46)33(43)24(4)30(39-48-19-15-18-47-27-16-13-12-14-17-27)22(2)21-37(7,45)34(25(5)31(41)26(6)35(44)50-29)51-36-32(42)28(40(9)10)20-23(3)49-36/h12-14,16-17,22-26,28-29,31-34,36,41-43,45-46H,11,15,18-21H2,1-10H3/b39-30+/t22-,23-,24-,25+,26-,28+,29+,31+,32-,33-,34-,36+,37?,38-/m1/s1