1-[3-[(2R,3S,4R,5R,8R,10R,11R,12S,13S,14R)-11-[(2R,3S,4R,6S)-4,6-dimethyl-3-oxidanyl-oxan-2-yl]oxy-2-ethyl-3,5,8,10,12,14-hexamethyl-3,4,10,13-tetrakis(oxidanyl)-15-oxidanylidene-1-oxa-6-azacyclopentadec-6-yl]propyl]-1-methyl-3-propan-2-yl-urea

Systemtic Name: 1-[3-[(2R,3S,4R,5R,8R,10R,11R,12S,13S,14R)-11-[(2R,3S,4R,6S)-4,6-dimethyl-3-oxidanyl-oxan-2-yl]oxy-2-ethyl-3,5,8,10,12,14-hexamethyl-3,4,10,13-tetrakis(oxidanyl)-15-oxidanylidene-1-oxa-6-azacyclopentadec-6-yl]propyl]-1-methyl-3-propan-2-yl-urea Openeye Name: 1-[3-[(2R,3S,4R,5R,8R,10R,11R,12S,13S,14R)-2-ethyl-3,4,10,13-tetrahydroxy-11-[(2R,3S,4R,6S)-3-hydroxy-4,6-dimethyl-tetrahydropyran-2-yl]oxy-3,5,8,10,12,14-hexamethyl-15-oxo-1-oxa-6-azacyclopentadec-6-yl]propyl]-3-isopropyl-1-methyl-urea CAS Name: 1-[3-[(2R,3S,4R,5R,8R,10R,11R,12S,13S,14R)-2-ethyl-3,4,10,13-tetrahydroxy-11-[[(2R,3S,4R,6S)-3-hydroxy-4,6-dimethyl-2-oxanyl]oxy]-3,5,8,10,12,14-hexamethyl-15-oxo-1-oxa-6-azacyclopentadec-6-yl]propyl]-1-methyl-3-propan-2-ylurea IUPAC Name: 1-[3-[(2R,3S,4R,5R,8R,10R,11R,12S,13S,14R)-2-ethyl-3,4,10,13-tetrahydroxy-11-[(2R,3S,4R,6S)-3-hydroxy-4,6-dimethyloxan-2-yl]oxy-3,5,8,10,12,14-hexamethyl-15-oxo-1-oxa-6-azacyclopentadec-6-yl]propyl]-1-methyl-3-propan-2-ylurea Traditional Name: 1-[3-[(2R,3S,4R,5R,8R,10R,11R,12S,13S,14R)-2-ethyl-3,4,10,13-tetrahydroxy-11-[(2R,3S,4R,6S)-3-hydroxy-4,6-dimethyl-tetrahydropyran-2-yl]oxy-15-keto-3,5,8,10,12,14-hexamethyl-1-oxa-6-azacyclopentadec-6-yl]propyl]-3-isopropyl-1-methyl-urea Formula: C36H69N3O10 MolecularWeight: 703.94716

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Descriptors Computed from Structure

Canonical SMILES:

CCC1C(C(C(N(CC(CC(C(C(C(C(C(=O)O1)C)O)C)OC2C(C(CC(O2)C)C)O)(C)O)C)CCCN(C)C(=O)NC(C)C)C)O)(C)O

Isomeric SMILES

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

InChI

InChI=1S/C36H69N3O10/c1-13-27-36(11,46)30(42)26(9)39(16-14-15-38(12)34(44)37-20(2)3)19-21(4)18-35(10,45)31(24(7)29(41)25(8)32(43)48-27)49-33-28(40)22(5)17-23(6)47-33/h20-31,33,40-42,45-46H,13-19H2,1-12H3,(H,37,44)/t21-,22-,23+,24+,25-,26-,27-,28+,29+,30-,31-,33-,35-,36-/m1/s1