[(3S,4S,6S)-6-[(3S,4R,6R)-6-[(3S,4R,6R)-6-[(3S,4R,6S)-5-azido-6-[tert-butyl(dimethyl)silyl]oxy-4-methyl-2-(phenylmethoxymethyl)oxan-3-yl]oxy-4,5-dimethyl-2-(phenylmethoxymethyl)oxan-3-yl]oxy-4,5-dimethyl-2-(phenylmethoxymethyl)oxan-3-yl]oxy-3,4,5-trimethyloxan-2-yl]methyl acetate;tert-butyl (4S)-5-[[(2S,4R,5S)-5-[(2R,4R,5S)-5-[(2R,4R,5S)-5-[(2S,4S,5S)-6-(acetyloxymethyl)-3,4,5-trimethyloxan-2-yl]oxy-3,4-dimethyl-6-(phenylmethoxymethyl)oxan-2-yl]oxy-3,4-dimethyl-6-(phenylmethoxymethyl)oxan-2-yl]oxy-2-[tert-butyl(dimethyl)silyl]oxy-4-methyl-6-(phenylmethoxymethyl)oxan-3-yl]amino]-4-[[(2S)-2-[[(2S)-2-(9H-fluoren-9-ylmethoxycarbonylamino)-5-oxohexanoyl]amino]-5-[(2-methylpropan-2-yl)oxy]-5-oxopentanoyl]amino]-5-oxopentanoate

C161H233N7O36Si2 — CID 161288320

About [(3S,4S,6S)-6-[(3S,4R,6R)-6-[(3S,4R,6R)-6-[(3S,4R,6S)-5-azido-6-[tert-butyl(dimethyl)silyl]oxy-4-methyl-2-(phenylmethoxymethyl)oxan-3-yl]oxy-4,5-dimethyl-2-(phenylmethoxymethyl)oxan-3-yl]oxy-4,5-dimethyl-2-(phenylmethoxymethyl)oxan-3-yl]oxy-3,4,5-trimethyloxan-2-yl]methyl acetate;tert-butyl (4S)-5-[[(2S,4R,5S)-5-[(2R,4R,5S)-5-[(2R,4R,5S)-5-[(2S,4S,5S)-6-(acetyloxymethyl)-3,4,5-trimethyloxan-2-yl]oxy-3,4-dimethyl-6-(phenylmethoxymethyl)oxan-2-yl]oxy-3,4-dimethyl-6-(phenylmethoxymethyl)oxan-2-yl]oxy-2-[tert-butyl(dimethyl)silyl]oxy-4-methyl-6-(phenylmethoxymethyl)oxan-3-yl]amino]-4-[[(2S)-2-[[(2S)-2-(9H-fluoren-9-ylmethoxycarbonylamino)-5-oxohexanoyl]amino]-5-[(2-methylpropan-2-yl)oxy]-5-oxopentanoyl]amino]-5-oxopentanoate

[(3S,4S,6S)-6-[(3S,4R,6R)-6-[(3S,4R,6R)-6-[(3S,4R,6S)-5-azido-6-[tert-butyl(dimethyl)silyl]oxy-4-methyl-2-(phenylmethoxymethyl)oxan-3-yl]oxy-4,5-dimethyl-2-(phenylmethoxymethyl)oxan-3-yl]oxy-4,5-dimethyl-2-(phenylmethoxymethyl)oxan-3-yl]oxy-3,4,5-trimethyloxan-2-yl]methyl acetate;tert-butyl (4S)-5-[[(2S,4R,5S)-5-[(2R,4R,5S)-5-[(2R,4R,5S)-5-[(2S,4S,5S)-6-(acetyloxymethyl)-3,4,5-trimethyloxan-2-yl]oxy-3,4-dimethyl-6-(phenylmethoxymethyl)oxan-2-yl]oxy-3,4-dimethyl-6-(phenylmethoxymethyl)oxan-2-yl]oxy-2-[tert-butyl(dimethyl)silyl]oxy-4-methyl-6-(phenylmethoxymethyl)oxan-3-yl]amino]-4-[[(2S)-2-[[(2S)-2-(9H-fluoren-9-ylmethoxycarbonylamino)-5-oxohexanoyl]amino]-5-[(2-methylpropan-2-yl)oxy]-5-oxopentanoyl]amino]-5-oxopentanoate (PubChem CID 161288320) has the molecular formula C161H233N7O36Si2 and a molecular weight of 2898.82 g/mol. Its IUPAC name is [(3S,4S,6S)-6-[(3S,4R,6R)-6-[(3S,4R,6R)-6-[(3S,4R,6S)-5-azido-6-[tert-butyl(dimethyl)silyl]oxy-4-methyl-2-(phenylmethoxymethyl)oxan-3-yl]oxy-4,5-dimethyl-2-(phenylmethoxymethyl)oxan-3-yl]oxy-4,5-dimethyl-2-(phenylmethoxymethyl)oxan-3-yl]oxy-3,4,5-trimethyloxan-2-yl]methyl acetate;tert-butyl (4S)-5-[[(2S,4R,5S)-5-[(2R,4R,5S)-5-[(2R,4R,5S)-5-[(2S,4S,5S)-6-(acetyloxymethyl)-3,4,5-trimethyloxan-2-yl]oxy-3,4-dimethyl-6-(phenylmethoxymethyl)oxan-2-yl]oxy-3,4-dimethyl-6-(phenylmethoxymethyl)oxan-2-yl]oxy-2-[tert-butyl(dimethyl)silyl]oxy-4-methyl-6-(phenylmethoxymethyl)oxan-3-yl]amino]-4-[[(2S)-2-[[(2S)-2-(9H-fluoren-9-ylmethoxycarbonylamino)-5-oxohexanoyl]amino]-5-[(2-methylpropan-2-yl)oxy]-5-oxopentanoyl]amino]-5-oxopentanoate.

Molecular Properties

• Compound Name: [(3S,4S,6S)-6-[(3S,4R,6R)-6-[(3S,4R,6R)-6-[(3S,4R,6S)-5-azido-6-[tert-butyl(dimethyl)silyl]oxy-4-methyl-2-(phenylmethoxymethyl)oxan-3-yl]oxy-4,5-dimethyl-2-(phenylmethoxymethyl)oxan-3-yl]oxy-4,5-dimethyl-2-(phenylmethoxymethyl)oxan-3-yl]oxy-3,4,5-trimethyloxan-2-yl]methyl acetate;tert-butyl (4S)-5-[[(2S,4R,5S)-5-[(2R,4R,5S)-5-[(2R,4R,5S)-5-[(2S,4S,5S)-6-(acetyloxymethyl)-3,4,5-trimethyloxan-2-yl]oxy-3,4-dimethyl-6-(phenylmethoxymethyl)oxan-2-yl]oxy-3,4-dimethyl-6-(phenylmethoxymethyl)oxan-2-yl]oxy-2-[tert-butyl(dimethyl)silyl]oxy-4-methyl-6-(phenylmethoxymethyl)oxan-3-yl]amino]-4-[[(2S)-2-[[(2S)-2-(9H-fluoren-9-ylmethoxycarbonylamino)-5-oxohexanoyl]amino]-5-[(2-methylpropan-2-yl)oxy]-5-oxopentanoyl]amino]-5-oxopentanoate
• PubChem CID: 161288320
• Molecular Formula: C161H233N7O36Si2
• Molecular Weight: 2898.82 g/mol
• Exact Mass: 2896.62
• IUPAC Name: [(3S,4S,6S)-6-[(3S,4R,6R)-6-[(3S,4R,6R)-6-[(3S,4R,6S)-5-azido-6-[tert-butyl(dimethyl)silyl]oxy-4-methyl-2-(phenylmethoxymethyl)oxan-3-yl]oxy-4,5-dimethyl-2-(phenylmethoxymethyl)oxan-3-yl]oxy-4,5-dimethyl-2-(phenylmethoxymethyl)oxan-3-yl]oxy-3,4,5-trimethyloxan-2-yl]methyl acetate;tert-butyl (4S)-5-[[(2S,4R,5S)-5-[(2R,4R,5S)-5-[(2R,4R,5S)-5-[(2S,4S,5S)-6-(acetyloxymethyl)-3,4,5-trimethyloxan-2-yl]oxy-3,4-dimethyl-6-(phenylmethoxymethyl)oxan-2-yl]oxy-3,4-dimethyl-6-(phenylmethoxymethyl)oxan-2-yl]oxy-2-[tert-butyl(dimethyl)silyl]oxy-4-methyl-6-(phenylmethoxymethyl)oxan-3-yl]amino]-4-[[(2S)-2-[[(2S)-2-(9H-fluoren-9-ylmethoxycarbonylamino)-5-oxohexanoyl]amino]-5-[(2-methylpropan-2-yl)oxy]-5-oxopentanoyl]amino]-5-oxopentanoate
• SMILES: CC(=O)CC[C@H](NC(=O)OCC1c2ccccc2-c2ccccc21)C(=O)N[C@@H](CCC(=O)OC(C)(C)C)C(=O)N[C@@H](CCC(=O)OC(C)(C)C)C(=O)NC1[C@H](O[Si](C)(C)C(C)(C)C)OC(COCc2ccccc2)[C@@H](O[C@@H]2OC(COCc3ccccc3)[C@@H](O[C@@H]3OC(COCc4ccccc4)[C@@H](O[C@@H]4OC(COC(C)=O)[C@@H](C)[C@H](C)C4C)C(C)C3C)[C@H](C)C2C)[C@@H]1C.CC(=O)OCC1O[C@@H](O[C@@H]2C(COCc3ccccc3)O[C@@H](O[C@@H]3C(COCc4ccccc4)O[C@@H](O[C@@H]4C(COCc5ccccc5)O[C@@H](O[Si](C)(C)C(C)(C)C)C(N=[N+]=[N-])[C@H]4C)C(C)[C@H]3C)C(C)[C@H]2C)C(C)[C@@H](C)[C@@H]1C
• InChI: InChI=1S/C100H142N4O23Si.C61H91N3O13Si/c1-59(105)45-46-79(103-97(112)117-54-76-74-43-33-31-41-72(74)73-42-32-34-44-75(73)76)91(110)101-77(47-49-84(107)125-98(11,12)13)90(109)102-78(48-50-85(108)126-99(14,15)16)92(111)104-86-67(9)89(83(57-115-53-71-39-29-24-30-40-71)121-96(86)127-128(20,21)100(17,18)19)124-95-66(8)63(5)88(82(120-95)56-114-52-70-37-27-23-28-38-70)123-94-65(7)62(4)87(81(119-94)55-113-51-69-35-25-22-26-36-69)122-93-64(6)60(2)61(3)80(118-93)58-116-68(10)106;1-37-38(2)49(36-69-45(9)65)70-57(41(37)5)74-54-39(3)42(6)58(71-50(54)33-66-30-46-24-18-15-19-25-46)75-55-40(4)43(7)59(72-51(55)34-67-31-47-26-20-16-21-27-47)76-56-44(8)53(63-64-62)60(77-78(13,14)61(10,11)12)73-52(56)35-68-32-48-28-22-17-23-29-48/h22-44,60-67,76-83,86-89,93-96H,45-58H2,1-21H3,(H,101,110)(H,102,109)(H,103,112)(H,104,111);15-29,37-44,49-60H,30-36H2,1-14H3/t60-,61-,62?,63+,64?,65?,66?,67+,77-,78-,79-,80?,81?,82?,83?,86?,87-,88-,89-,93-,94-,95-,96-;37-,38-,39+,40+,41?,42?,43?,44+,49?,50?,51?,52?,53?,54-,55-,56-,57-,58-,59-,60-/m00/s1
• InChIKey: VGABBXJYLMWESB-PZOZGGGBSA-N
• XLogP: 27.39
• TPSA: 499.72 Ų
• H-Bond Donors: 4
• H-Bond Acceptors: 37
• Rotatable Bonds: 63
• Heavy Atoms: 206
• Complexity: —

Lipinski Rule of Five

3 violations

Rule	Value
MW ≤ 500	2898.82
LogP ≤ 5	27.39
H-Bond Donors ≤ 5	4
H-Bond Acceptors ≤ 10	37

Computed Properties (RDKit)

• Structural Alerts: {'alert_name': 'azo_A(324)', 'substructure': 'N/A'}, {'alert_name': '>_2_ester_groups', 'substructure': 'N/A'}, {'alert_name': 'Azido_group', 'substructure': 'N/A'}, {'alert_name': 'diazo_group', 'substructure': 'N/A'}, {'alert_name': 'heavy_metal', 'substructure': 'N/A'}

Frequently Asked Questions

What is the IUPAC name of [(3S,4S,6S)-6-[(3S,4R,6R)-6-[(3S,4R,6R)-6-[(3S,4R,6S)-5-azido-6-[tert-butyl(dimethyl)silyl]oxy-4-methyl-2-(phenylmethoxymethyl)oxan-3-yl]oxy-4,5-dimethyl-2-(phenylmethoxymethyl)oxan-3-yl]oxy-4,5-dimethyl-2-(phenylmethoxymethyl)oxan-3-yl]oxy-3,4,5-trimethyloxan-2-yl]methyl acetate;tert-butyl (4S)-5-[[(2S,4R,5S)-5-[(2R,4R,5S)-5-[(2R,4R,5S)-5-[(2S,4S,5S)-6-(acetyloxymethyl)-3,4,5-trimethyloxan-2-yl]oxy-3,4-dimethyl-6-(phenylmethoxymethyl)oxan-2-yl]oxy-3,4-dimethyl-6-(phenylmethoxymethyl)oxan-2-yl]oxy-2-[tert-butyl(dimethyl)silyl]oxy-4-methyl-6-(phenylmethoxymethyl)oxan-3-yl]amino]-4-[[(2S)-2-[[(2S)-2-(9H-fluoren-9-ylmethoxycarbonylamino)-5-oxohexanoyl]amino]-5-[(2-methylpropan-2-yl)oxy]-5-oxopentanoyl]amino]-5-oxopentanoate?

The IUPAC name of [(3S,4S,6S)-6-[(3S,4R,6R)-6-[(3S,4R,6R)-6-[(3S,4R,6S)-5-azido-6-[tert-butyl(dimethyl)silyl]oxy-4-methyl-2-(phenylmethoxymethyl)oxan-3-yl]oxy-4,5-dimethyl-2-(phenylmethoxymethyl)oxan-3-yl]oxy-4,5-dimethyl-2-(phenylmethoxymethyl)oxan-3-yl]oxy-3,4,5-trimethyloxan-2-yl]methyl acetate;tert-butyl (4S)-5-[[(2S,4R,5S)-5-[(2R,4R,5S)-5-[(2R,4R,5S)-5-[(2S,4S,5S)-6-(acetyloxymethyl)-3,4,5-trimethyloxan-2-yl]oxy-3,4-dimethyl-6-(phenylmethoxymethyl)oxan-2-yl]oxy-3,4-dimethyl-6-(phenylmethoxymethyl)oxan-2-yl]oxy-2-[tert-butyl(dimethyl)silyl]oxy-4-methyl-6-(phenylmethoxymethyl)oxan-3-yl]amino]-4-[[(2S)-2-[[(2S)-2-(9H-fluoren-9-ylmethoxycarbonylamino)-5-oxohexanoyl]amino]-5-[(2-methylpropan-2-yl)oxy]-5-oxopentanoyl]amino]-5-oxopentanoate (CID 161288320) is [(3S,4S,6S)-6-[(3S,4R,6R)-6-[(3S,4R,6R)-6-[(3S,4R,6S)-5-azido-6-[tert-butyl(dimethyl)silyl]oxy-4-methyl-2-(phenylmethoxymethyl)oxan-3-yl]oxy-4,5-dimethyl-2-(phenylmethoxymethyl)oxan-3-yl]oxy-4,5-dimethyl-2-(phenylmethoxymethyl)oxan-3-yl]oxy-3,4,5-trimethyloxan-2-yl]methyl acetate;tert-butyl (4S)-5-[[(2S,4R,5S)-5-[(2R,4R,5S)-5-[(2R,4R,5S)-5-[(2S,4S,5S)-6-(acetyloxymethyl)-3,4,5-trimethyloxan-2-yl]oxy-3,4-dimethyl-6-(phenylmethoxymethyl)oxan-2-yl]oxy-3,4-dimethyl-6-(phenylmethoxymethyl)oxan-2-yl]oxy-2-[tert-butyl(dimethyl)silyl]oxy-4-methyl-6-(phenylmethoxymethyl)oxan-3-yl]amino]-4-[[(2S)-2-[[(2S)-2-(9H-fluoren-9-ylmethoxycarbonylamino)-5-oxohexanoyl]amino]-5-[(2-methylpropan-2-yl)oxy]-5-oxopentanoyl]amino]-5-oxopentanoate.

What is the SMILES notation for [(3S,4S,6S)-6-[(3S,4R,6R)-6-[(3S,4R,6R)-6-[(3S,4R,6S)-5-azido-6-[tert-butyl(dimethyl)silyl]oxy-4-methyl-2-(phenylmethoxymethyl)oxan-3-yl]oxy-4,5-dimethyl-2-(phenylmethoxymethyl)oxan-3-yl]oxy-4,5-dimethyl-2-(phenylmethoxymethyl)oxan-3-yl]oxy-3,4,5-trimethyloxan-2-yl]methyl acetate;tert-butyl (4S)-5-[[(2S,4R,5S)-5-[(2R,4R,5S)-5-[(2R,4R,5S)-5-[(2S,4S,5S)-6-(acetyloxymethyl)-3,4,5-trimethyloxan-2-yl]oxy-3,4-dimethyl-6-(phenylmethoxymethyl)oxan-2-yl]oxy-3,4-dimethyl-6-(phenylmethoxymethyl)oxan-2-yl]oxy-2-[tert-butyl(dimethyl)silyl]oxy-4-methyl-6-(phenylmethoxymethyl)oxan-3-yl]amino]-4-[[(2S)-2-[[(2S)-2-(9H-fluoren-9-ylmethoxycarbonylamino)-5-oxohexanoyl]amino]-5-[(2-methylpropan-2-yl)oxy]-5-oxopentanoyl]amino]-5-oxopentanoate?

The canonical SMILES for [(3S,4S,6S)-6-[(3S,4R,6R)-6-[(3S,4R,6R)-6-[(3S,4R,6S)-5-azido-6-[tert-butyl(dimethyl)silyl]oxy-4-methyl-2-(phenylmethoxymethyl)oxan-3-yl]oxy-4,5-dimethyl-2-(phenylmethoxymethyl)oxan-3-yl]oxy-4,5-dimethyl-2-(phenylmethoxymethyl)oxan-3-yl]oxy-3,4,5-trimethyloxan-2-yl]methyl acetate;tert-butyl (4S)-5-[[(2S,4R,5S)-5-[(2R,4R,5S)-5-[(2R,4R,5S)-5-[(2S,4S,5S)-6-(acetyloxymethyl)-3,4,5-trimethyloxan-2-yl]oxy-3,4-dimethyl-6-(phenylmethoxymethyl)oxan-2-yl]oxy-3,4-dimethyl-6-(phenylmethoxymethyl)oxan-2-yl]oxy-2-[tert-butyl(dimethyl)silyl]oxy-4-methyl-6-(phenylmethoxymethyl)oxan-3-yl]amino]-4-[[(2S)-2-[[(2S)-2-(9H-fluoren-9-ylmethoxycarbonylamino)-5-oxohexanoyl]amino]-5-[(2-methylpropan-2-yl)oxy]-5-oxopentanoyl]amino]-5-oxopentanoate is CC(=O)CC[C@H](NC(=O)OCC1c2ccccc2-c2ccccc21)C(=O)N[C@@H](CCC(=O)OC(C)(C)C)C(=O)N[C@@H](CCC(=O)OC(C)(C)C)C(=O)NC1[C@H](O[Si](C)(C)C(C)(C)C)OC(COCc2ccccc2)[C@@H](O[C@@H]2OC(COCc3ccccc3)[C@@H](O[C@@H]3OC(COCc4ccccc4)[C@@H](O[C@@H]4OC(COC(C)=O)[C@@H](C)[C@H](C)C4C)C(C)C3C)[C@H](C)C2C)[C@@H]1C.CC(=O)OCC1O[C@@H](O[C@@H]2C(COCc3ccccc3)O[C@@H](O[C@@H]3C(COCc4ccccc4)O[C@@H](O[C@@H]4C(COCc5ccccc5)O[C@@H](O[Si](C)(C)C(C)(C)C)C(N=[N+]=[N-])[C@H]4C)C(C)[C@H]3C)C(C)[C@H]2C)C(C)[C@@H](C)[C@@H]1C.

What is the InChIKey of [(3S,4S,6S)-6-[(3S,4R,6R)-6-[(3S,4R,6R)-6-[(3S,4R,6S)-5-azido-6-[tert-butyl(dimethyl)silyl]oxy-4-methyl-2-(phenylmethoxymethyl)oxan-3-yl]oxy-4,5-dimethyl-2-(phenylmethoxymethyl)oxan-3-yl]oxy-4,5-dimethyl-2-(phenylmethoxymethyl)oxan-3-yl]oxy-3,4,5-trimethyloxan-2-yl]methyl acetate;tert-butyl (4S)-5-[[(2S,4R,5S)-5-[(2R,4R,5S)-5-[(2R,4R,5S)-5-[(2S,4S,5S)-6-(acetyloxymethyl)-3,4,5-trimethyloxan-2-yl]oxy-3,4-dimethyl-6-(phenylmethoxymethyl)oxan-2-yl]oxy-3,4-dimethyl-6-(phenylmethoxymethyl)oxan-2-yl]oxy-2-[tert-butyl(dimethyl)silyl]oxy-4-methyl-6-(phenylmethoxymethyl)oxan-3-yl]amino]-4-[[(2S)-2-[[(2S)-2-(9H-fluoren-9-ylmethoxycarbonylamino)-5-oxohexanoyl]amino]-5-[(2-methylpropan-2-yl)oxy]-5-oxopentanoyl]amino]-5-oxopentanoate?

The InChIKey is VGABBXJYLMWESB-PZOZGGGBSA-N. The full InChI is InChI=1S/C100H142N4O23Si.C61H91N3O13Si/c1-59(105)45-46-79(103-97(112)117-54-76-74-43-33-31-41-72(74)73-42-32-34-44-75(73)76)91(110)101-77(47-49-84(107)125-98(11,12)13)90(109)102-78(48-50-85(108)126-99(14,15)16)92(111)104-86-67(9)89(83(57-115-53-71-39-29-24-30-40-71)121-96(86)127-128(20,21)100(17,18)19)124-95-66(8)63(5)88(82(120-95)56-114-52-70-37-27-23-28-38-70)123-94-65(7)62(4)87(81(119-94)55-113-51-69-35-25-22-26-36-69)122-93-64(6)60(2)61(3)80(118-93)58-116-68(10)106;1-37-38(2)49(36-69-45(9)65)70-57(41(37)5)74-54-39(3)42(6)58(71-50(54)33-66-30-46-24-18-15-19-25-46)75-55-40(4)43(7)59(72-51(55)34-67-31-47-26-20-16-21-27-47)76-56-44(8)53(63-64-62)60(77-78(13,14)61(10,11)12)73-52(56)35-68-32-48-28-22-17-23-29-48/h22-44,60-67,76-83,86-89,93-96H,45-58H2,1-21H3,(H,101,110)(H,102,109)(H,103,112)(H,104,111);15-29,37-44,49-60H,30-36H2,1-14H3/t60-,61-,62?,63+,64?,65?,66?,67+,77-,78-,79-,80?,81?,82?,83?,86?,87-,88-,89-,93-,94-,95-,96-;37-,38-,39+,40+,41?,42?,43?,44+,49?,50?,51?,52?,53?,54-,55-,56-,57-,58-,59-,60-/m00/s1.

What are the key properties of [(3S,4S,6S)-6-[(3S,4R,6R)-6-[(3S,4R,6R)-6-[(3S,4R,6S)-5-azido-6-[tert-butyl(dimethyl)silyl]oxy-4-methyl-2-(phenylmethoxymethyl)oxan-3-yl]oxy-4,5-dimethyl-2-(phenylmethoxymethyl)oxan-3-yl]oxy-4,5-dimethyl-2-(phenylmethoxymethyl)oxan-3-yl]oxy-3,4,5-trimethyloxan-2-yl]methyl acetate;tert-butyl (4S)-5-[[(2S,4R,5S)-5-[(2R,4R,5S)-5-[(2R,4R,5S)-5-[(2S,4S,5S)-6-(acetyloxymethyl)-3,4,5-trimethyloxan-2-yl]oxy-3,4-dimethyl-6-(phenylmethoxymethyl)oxan-2-yl]oxy-3,4-dimethyl-6-(phenylmethoxymethyl)oxan-2-yl]oxy-2-[tert-butyl(dimethyl)silyl]oxy-4-methyl-6-(phenylmethoxymethyl)oxan-3-yl]amino]-4-[[(2S)-2-[[(2S)-2-(9H-fluoren-9-ylmethoxycarbonylamino)-5-oxohexanoyl]amino]-5-[(2-methylpropan-2-yl)oxy]-5-oxopentanoyl]amino]-5-oxopentanoate?

[(3S,4S,6S)-6-[(3S,4R,6R)-6-[(3S,4R,6R)-6-[(3S,4R,6S)-5-azido-6-[tert-butyl(dimethyl)silyl]oxy-4-methyl-2-(phenylmethoxymethyl)oxan-3-yl]oxy-4,5-dimethyl-2-(phenylmethoxymethyl)oxan-3-yl]oxy-4,5-dimethyl-2-(phenylmethoxymethyl)oxan-3-yl]oxy-3,4,5-trimethyloxan-2-yl]methyl acetate;tert-butyl (4S)-5-[[(2S,4R,5S)-5-[(2R,4R,5S)-5-[(2R,4R,5S)-5-[(2S,4S,5S)-6-(acetyloxymethyl)-3,4,5-trimethyloxan-2-yl]oxy-3,4-dimethyl-6-(phenylmethoxymethyl)oxan-2-yl]oxy-3,4-dimethyl-6-(phenylmethoxymethyl)oxan-2-yl]oxy-2-[tert-butyl(dimethyl)silyl]oxy-4-methyl-6-(phenylmethoxymethyl)oxan-3-yl]amino]-4-[[(2S)-2-[[(2S)-2-(9H-fluoren-9-ylmethoxycarbonylamino)-5-oxohexanoyl]amino]-5-[(2-methylpropan-2-yl)oxy]-5-oxopentanoyl]amino]-5-oxopentanoate has a molecular weight of 2898.82 g/mol, XLogP of 27.39, 63 rotatable bonds, 4 hydrogen bond donors, and 37 hydrogen bond acceptors.

Where does this data come from?

All data for [(3S,4S,6S)-6-[(3S,4R,6R)-6-[(3S,4R,6R)-6-[(3S,4R,6S)-5-azido-6-[tert-butyl(dimethyl)silyl]oxy-4-methyl-2-(phenylmethoxymethyl)oxan-3-yl]oxy-4,5-dimethyl-2-(phenylmethoxymethyl)oxan-3-yl]oxy-4,5-dimethyl-2-(phenylmethoxymethyl)oxan-3-yl]oxy-3,4,5-trimethyloxan-2-yl]methyl acetate;tert-butyl (4S)-5-[[(2S,4R,5S)-5-[(2R,4R,5S)-5-[(2R,4R,5S)-5-[(2S,4S,5S)-6-(acetyloxymethyl)-3,4,5-trimethyloxan-2-yl]oxy-3,4-dimethyl-6-(phenylmethoxymethyl)oxan-2-yl]oxy-3,4-dimethyl-6-(phenylmethoxymethyl)oxan-2-yl]oxy-2-[tert-butyl(dimethyl)silyl]oxy-4-methyl-6-(phenylmethoxymethyl)oxan-3-yl]amino]-4-[[(2S)-2-[[(2S)-2-(9H-fluoren-9-ylmethoxycarbonylamino)-5-oxohexanoyl]amino]-5-[(2-methylpropan-2-yl)oxy]-5-oxopentanoyl]amino]-5-oxopentanoate is sourced from PubChem (CID 161288320), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).