(2S,3R,4R,5R,6R)-2-[[(2S,3S,4S,5S,6S)-5-azanyl-6-[10-[(4-methoxyphenyl)methoxy]decyl]-4-phenylmethoxy-2-(phenylmethoxymethyl)oxan-3-yl]methyl]-3-[[(2S,3R,4R,5R,6S)-6-methyl-3,4,5-tris(phenylmethoxy)oxan-2-yl]methyl]-5-phenylmethoxy-6-(phenylmethoxymethyl)oxan-4-ol

Systemtic Name: (2S,3R,4R,5R,6R)-2-[[(2S,3S,4S,5S,6S)-5-azanyl-6-[10-[(4-methoxyphenyl)methoxy]decyl]-4-phenylmethoxy-2-(phenylmethoxymethyl)oxan-3-yl]methyl]-3-[[(2S,3R,4R,5R,6S)-6-methyl-3,4,5-tris(phenylmethoxy)oxan-2-yl]methyl]-5-phenylmethoxy-6-(phenylmethoxymethyl)oxan-4-ol Openeye Name: (2S,3R,4R,5R,6R)-2-[[(2S,3S,4S,5S,6S)-5-amino-4-benzyloxy-2-(benzyloxymethyl)-6-[10-[(4-methoxyphenyl)methoxy]decyl]tetrahydropyran-3-yl]methyl]-5-benzyloxy-6-(benzyloxymethyl)-3-[[(2S,3R,4R,5R,6S)-3,4,5-tribenzyloxy-6-methyl-tetrahydropyran-2-yl]methyl]tetrahydropyran-4-ol CAS Name: (2S,3R,4R,5R,6R)-2-[[(2S,3S,4S,5S,6S)-5-amino-6-[10-[(4-methoxyphenyl)methoxy]decyl]-4-phenylmethoxy-2-(phenylmethoxymethyl)-3-oxanyl]methyl]-3-[[(2S,3R,4R,5R,6S)-6-methyl-3,4,5-tris(phenylmethoxy)-2-oxanyl]methyl]-5-phenylmethoxy-6-(phenylmethoxymethyl)-4-oxanol IUPAC Name: (2S,3R,4R,5R,6R)-2-[[(2S,3S,4S,5S,6S)-5-amino-6-[10-[(4-methoxyphenyl)methoxy]decyl]-4-phenylmethoxy-2-(phenylmethoxymethyl)oxan-3-yl]methyl]-3-[[(2S,3R,4R,5R,6S)-6-methyl-3,4,5-tris(phenylmethoxy)oxan-2-yl]methyl]-5-phenylmethoxy-6-(phenylmethoxymethyl)oxan-4-ol Traditional Name: (2S,3R,4R,5R,6R)-2-[[(2S,3S,4S,5S,6S)-5-amino-4-benzoxy-2-(benzoxymethyl)-6-(10-p-anisyloxydecyl)tetrahydropyran-3-yl]methyl]-5-benzoxy-6-(benzoxymethyl)-3-[[(2S,3R,4R,5R,6S)-3,4,5-tribenzoxy-6-methyl-tetrahydropyran-2-yl]methyl]tetrahydropyran-4-ol Formula: C87H107NO13 MolecularWeight: 1374.77938

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Descriptors Computed from Structure

Canonical SMILES:

CC1C(C(C(C(O1)CC2C(OC(C(C2O)OCC3=CC=CC=C3)COCC4=CC=CC=C4)CC5C(OC(C(C5OCC6=CC=CC=C6)N)CCCCCCCCCCOCC7=CC=C(C=C7)OC)COCC8=CC=CC=C8)OCC9=CC=CC=C9)OCC1=CC=CC=C1)OCC1=CC=CC=C1

Isomeric SMILES

C[C@H]1[C@H]([C@H]([C@@H]([C@@H](O1)C[C@H]2[C@@H](O[C@@H]([C@@H]([C@@H]2O)OCC3=CC=CC=C3)COCC4=CC=CC=C4)C[C@@H]5[C@H](O[C@H]([C@@H]([C@H]5OCC6=CC=CC=C6)N)CCCCCCCCCCOCC7=CC=C(C=C7)OC)COCC8=CC=CC=C8)OCC9=CC=CC=C9)OCC1=CC=CC=C1)OCC1=CC=CC=C1

InChI

InChI=1S/C87H107NO13/c1-64-83(94-57-67-36-20-11-21-37-67)87(98-61-71-44-28-15-29-45-71)86(97-60-70-42-26-14-27-43-70)78(99-64)52-74-77(101-80(63-93-56-66-34-18-10-19-35-66)85(82(74)89)96-59-69-40-24-13-25-41-69)53-75-79(62-92-55-65-32-16-9-17-33-65)100-76(81(88)84(75)95-58-68-38-22-12-23-39-68)46-30-7-5-3-4-6-8-31-51-91-54-72-47-49-73(90-2)50-48-72/h9-29,32-45,47-50,64,74-87,89H,3-8,30-31,46,51-63,88H2,1-2H3/t64-,74-,75+,76-,77-,78-,79+,80+,81-,82+,83+,84-,85-,86+,87+/m0/s1