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(2S,4R,6S,7R,8R,13S,14S)-7-[(2S,3R,4S,6R)-4-(dimethylamino)-6-methyl-3-oxidanyl-oxan-2-yl]oxy-13-ethyl-2,4,6,8,10,14-hexamethyl-10-oxidanyl-6-(2-oxidanylpropoxy)-12,15-dioxa-17-azabicyclo[12.3.0]heptadecane-3,9,11,16-tetrone

(2S,4R,6S,7R,8R,13S,14S)-7-[(2S,3R,4S,6R)-4-(dimethylamino)-6-methyl-3-oxidanyl-oxan-2-yl]oxy-13-ethyl-2,4,6,8,10,14-hexamethyl-10-oxidanyl-6-(2-oxidanylpropoxy)-12,15-dioxa-17-azabicyclo[12.3.0]heptadecane-3,9,11,16-tetrone

Systemtic Name:(2S,4R,6S,7R,8R,13S,14S)-7-[(2S,3R,4S,6R)-4-(dimethylamino)-6-methyl-3-oxidanyl-oxan-2-yl]oxy-13-ethyl-2,4,6,8,10,14-hexamethyl-10-oxidanyl-6-(2-oxidanylpropoxy)-12,15-dioxa-17-azabicyclo[12.3.0]heptadecane-3,9,11,16-tetrone
Openeye Name:(2S,4R,6S,7R,8R,13S,14S)-7-[(2S,3R,4S,6R)-4-(dimethylamino)-3-hydroxy-6-methyl-tetrahydropyran-2-yl]oxy-13-ethyl-10-hydroxy-6-(2-hydroxypropoxy)-2,4,6,8,10,14-hexamethyl-12,15-dioxa-17-azabicyclo[12.3.0]heptadecane-3,9,11,16-tetrone
CAS Name:(2S,4R,6S,7R,8R,13S,14S)-7-[[(2S,3R,4S,6R)-4-(dimethylamino)-3-hydroxy-6-methyl-2-oxanyl]oxy]-13-ethyl-10-hydroxy-6-(2-hydroxypropoxy)-2,4,6,8,10,14-hexamethyl-12,15-dioxa-17-azabicyclo[12.3.0]heptadecane-3,9,11,16-tetrone
IUPAC Name:(2S,4R,6S,7R,8R,13S,14S)-7-[(2S,3R,4S,6R)-4-(dimethylamino)-3-hydroxy-6-methyloxan-2-yl]oxy-13-ethyl-10-hydroxy-6-(2-hydroxypropoxy)-2,4,6,8,10,14-hexamethyl-12,15-dioxa-17-azabicyclo[12.3.0]heptadecane-3,9,11,16-tetrone
Traditional Name:(2S,4R,6S,7R,8R,13S,14S)-7-[(2S,3R,4S,6R)-4-(dimethylamino)-3-hydroxy-6-methyl-tetrahydropyran-2-yl]oxy-13-ethyl-10-hydroxy-6-(2-hydroxypropoxy)-2,4,6,8,10,14-hexamethyl-12,15-dioxa-17-azabicyclo[12.3.0]heptadecane-3,9,11,16-diquinone
Formula: C33H56N2O12
MolecularWeight: 672.80394
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Descriptors Computed from Structure

Canonical SMILES:

CCC1C2(C(C(C(=O)C(CC(C(C(C(=O)C(C(=O)O1)(C)O)C)OC3C(C(CC(O3)C)N(C)C)O)(C)OCC(C)O)C)C)NC(=O)O2)C


Isomeric SMILES

CC[C@H]1[C@@]2(C([C@@H](C(=O)[C@@H](C[C@]([C@@H]([C@H](C(=O)C(C(=O)O1)(C)O)C)O[C@H]3[C@@H]([C@H](C[C@H](O3)C)N(C)C)O)(C)OCC(C)O)C)C)NC(=O)O2)C


InChI

InChI=1S/C33H56N2O12/c1-12-22-33(9)25(34-30(41)47-33)19(5)23(37)16(2)14-31(7,43-15-17(3)36)27(20(6)26(39)32(8,42)29(40)45-22)46-28-24(38)21(35(10)11)13-18(4)44-28/h16-22,24-25,27-28,36,38,42H,12-15H2,1-11H3,(H,34,41)/t16-,17?,18-,19-,20+,21+,22+,24-,25?,27-,28+,31+,32?,33-/m1/s1


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