N-[[(2S,6S)-4-[[(2S,6S)-4-[[(2S)-4-[[(2S,6R)-4-[[(2S,6S)-4-[[(2S,6S)-4-[[(2S,6S)-4,6-dimethylmorpholin-2-yl]methoxy-methylphosphoryl]-6-tritiomorpholin-2-yl]methoxy-methylphosphoryl]-6-methylmorpholin-2-yl]methoxy-methylphosphoryl]-6-tritiomorpholin-2-yl]methoxy-methylphosphoryl]morpholin-6-id-2-yl]methoxy-methylphosphoryl]-6-methylmorpholin-2-yl]methoxy-methylphosphoryl]-6-methylmorpholin-2-yl]methoxy-methylphosphoryl]-N-methylmethanamine;yttrium

C49H100N8O21P7Y- — CID 160658096

IUPACN-[[(2S,6S)-4-[[(2S,6S)-4-[[(2S)-4-[[(2S,6R)-4-[[(2S,6S)-4-[[(2S,6S)-4-[[(2S,6S)-4,6-dimethylmorpholin-2-yl]methoxy-methylphosphoryl]-6-tritiomorpholin-2-yl]methoxy-methylphosphoryl]-6-methylmorpholin-2-yl]methoxy-methylphosphoryl]-6-tritiomorpholin-2-yl]methoxy-methylphosphoryl]morpholin-6-id-2-yl]methoxy-methylphosphoryl]-6-methylmorpholin-2-yl]methoxy-methylphosphoryl]-6-methylmorpholin-2-yl]methoxy-methylphosphoryl]-N-methylmethanamine;yttrium
SMILES[3H][C@@H]1CN(P(C)(=O)OC[C@@H]2CN(P(C)(=O)OC[C@@H]3CN(P(C)(=O)OC[C@@H]4CN(C)C[C@H](C)O4)C[C@H]([3H])O3)C[C@H](C)O2)C[C@@H](COP(C)(=O)N2C[CH-]O[C@H](COP(C)(=O)N3C[C@@H](COP(C)(=O)N4C[C@@H](COP(C)(=O)N(C)C)O[C@@H](C)C4)O[C@@H](C)C3)C2)O1.[Y]
InChIInChI=1S/C49H100N8O21P7.Y/c1-39-21-51(7)25-46(75-39)35-72-81(10,60)53-16-20-67-45(28-53)34-71-83(12,62)55-22-41(3)77-48(30-55)37-73-82(11,61)54-17-19-65-43(26-54)32-69-80(9,59)52-15-18-66-44(27-52)33-70-84(13,63)56-23-42(4)78-49(31-56)38-74-85(14,64)57-24-40(2)76-47(29-57)36-68-79(8,58)50(5)6;/h18,39-49H,15-17,19-38H2,1-14H3;/q-1;/t39-,40-,41-,42-,43-,44-,45-,46-,47-,48-,49-,79?,80?,81?,82?,83?,84?,85?;/m0./s1/i19T,20T;/t19-,20+,39+,40+,41+,42+,43+,44+,45+,46+,47+,48+,49+,79?,80?,81?,82?,83?,84?,85?;/m1.
InChIKeyFOOGAUPRZXFDAT-GUFHRCFGSA-N
MW1447.11 g/mol
LogP5.67
Rot. Bonds28

About N-[[(2S,6S)-4-[[(2S,6S)-4-[[(2S)-4-[[(2S,6R)-4-[[(2S,6S)-4-[[(2S,6S)-4-[[(2S,6S)-4,6-dimethylmorpholin-2-yl]methoxy-methylphosphoryl]-6-tritiomorpholin-2-yl]methoxy-methylphosphoryl]-6-methylmorpholin-2-yl]methoxy-methylphosphoryl]-6-tritiomorpholin-2-yl]methoxy-methylphosphoryl]morpholin-6-id-2-yl]methoxy-methylphosphoryl]-6-methylmorpholin-2-yl]methoxy-methylphosphoryl]-6-methylmorpholin-2-yl]methoxy-methylphosphoryl]-N-methylmethanamine;yttrium

N-[[(2S,6S)-4-[[(2S,6S)-4-[[(2S)-4-[[(2S,6R)-4-[[(2S,6S)-4-[[(2S,6S)-4-[[(2S,6S)-4,6-dimethylmorpholin-2-yl]methoxy-methylphosphoryl]-6-tritiomorpholin-2-yl]methoxy-methylphosphoryl]-6-methylmorpholin-2-yl]methoxy-methylphosphoryl]-6-tritiomorpholin-2-yl]methoxy-methylphosphoryl]morpholin-6-id-2-yl]methoxy-methylphosphoryl]-6-methylmorpholin-2-yl]methoxy-methylphosphoryl]-6-methylmorpholin-2-yl]methoxy-methylphosphoryl]-N-methylmethanamine;yttrium (PubChem CID 160658096) has the molecular formula C49H100N8O21P7Y- and a molecular weight of 1447.11 g/mol. Its IUPAC name is N-[[(2S,6S)-4-[[(2S,6S)-4-[[(2S)-4-[[(2S,6R)-4-[[(2S,6S)-4-[[(2S,6S)-4-[[(2S,6S)-4,6-dimethylmorpholin-2-yl]methoxy-methylphosphoryl]-6-tritiomorpholin-2-yl]methoxy-methylphosphoryl]-6-methylmorpholin-2-yl]methoxy-methylphosphoryl]-6-tritiomorpholin-2-yl]methoxy-methylphosphoryl]morpholin-6-id-2-yl]methoxy-methylphosphoryl]-6-methylmorpholin-2-yl]methoxy-methylphosphoryl]-6-methylmorpholin-2-yl]methoxy-methylphosphoryl]-N-methylmethanamine;yttrium.

Molecular Properties

Compound NameN-[[(2S,6S)-4-[[(2S,6S)-4-[[(2S)-4-[[(2S,6R)-4-[[(2S,6S)-4-[[(2S,6S)-4-[[(2S,6S)-4,6-dimethylmorpholin-2-yl]methoxy-methylphosphoryl]-6-tritiomorpholin-2-yl]methoxy-methylphosphoryl]-6-methylmorpholin-2-yl]methoxy-methylphosphoryl]-6-tritiomorpholin-2-yl]methoxy-methylphosphoryl]morpholin-6-id-2-yl]methoxy-methylphosphoryl]-6-methylmorpholin-2-yl]methoxy-methylphosphoryl]-6-methylmorpholin-2-yl]methoxy-methylphosphoryl]-N-methylmethanamine;yttrium
PubChem CID160658096
Molecular FormulaC49H100N8O21P7Y-
Molecular Weight1447.11 g/mol
Exact Mass1446.44
IUPAC NameN-[[(2S,6S)-4-[[(2S,6S)-4-[[(2S)-4-[[(2S,6R)-4-[[(2S,6S)-4-[[(2S,6S)-4-[[(2S,6S)-4,6-dimethylmorpholin-2-yl]methoxy-methylphosphoryl]-6-tritiomorpholin-2-yl]methoxy-methylphosphoryl]-6-methylmorpholin-2-yl]methoxy-methylphosphoryl]-6-tritiomorpholin-2-yl]methoxy-methylphosphoryl]morpholin-6-id-2-yl]methoxy-methylphosphoryl]-6-methylmorpholin-2-yl]methoxy-methylphosphoryl]-6-methylmorpholin-2-yl]methoxy-methylphosphoryl]-N-methylmethanamine;yttrium
SMILES[3H][C@@H]1CN(P(C)(=O)OC[C@@H]2CN(P(C)(=O)OC[C@@H]3CN(P(C)(=O)OC[C@@H]4CN(C)C[C@H](C)O4)C[C@H]([3H])O3)C[C@H](C)O2)C[C@@H](COP(C)(=O)N2C[CH-]O[C@H](COP(C)(=O)N3C[C@@H](COP(C)(=O)N4C[C@@H](COP(C)(=O)N(C)C)O[C@@H](C)C4)O[C@@H](C)C3)C2)O1.[Y]
InChIInChI=1S/C49H100N8O21P7.Y/c1-39-21-51(7)25-46(75-39)35-72-81(10,60)53-16-20-67-45(28-53)34-71-83(12,62)55-22-41(3)77-48(30-55)37-73-82(11,61)54-17-19-65-43(26-54)32-69-80(9,59)52-15-18-66-44(27-52)33-70-84(13,63)56-23-42(4)78-49(31-56)38-74-85(14,64)57-24-40(2)76-47(29-57)36-68-79(8,58)50(5)6;/h18,39-49H,15-17,19-38H2,1-14H3;/q-1;/t39-,40-,41-,42-,43-,44-,45-,46-,47-,48-,49-,79?,80?,81?,82?,83?,84?,85?;/m0./s1/i19T,20T;/t19-,20+,39+,40+,41+,42+,43+,44+,45+,46+,47+,48+,49+,79?,80?,81?,82?,83?,84?,85?;/m1.
InChIKeyFOOGAUPRZXFDAT-GUFHRCFGSA-N
XLogP5.67
TPSA274.63 Ų
H-Bond Donors
H-Bond Acceptors22
Rotatable Bonds28
Heavy Atoms86
Complexity—

Lipinski Rule of Five

3 violations

RuleValue
MW ≤ 5001447.11
LogP ≤ 55.67
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 1022

Computed Properties (RDKit)

Structural Alerts{'alert_name': 'Carbo_cation/anion', 'substructure': 'N/A'}, {'alert_name': 'phosphor', 'substructure': 'N/A'}

Analyze N-[[(2S,6S)-4-[[(2S,6S)-4-[[(2S)-4-[[(2S,6R)-4-[[(2S,6S)-4-[[(2S,6S)-4-[[(2S,6S)-4,6-dimethylmorpholin-2-yl]methoxy-methylphosphoryl]-6-tritiomorpholin-2-yl]methoxy-methylphosphoryl]-6-methylmorpholin-2-yl]methoxy-methylphosphoryl]-6-tritiomorpholin-2-yl]methoxy-methylphosphoryl]morpholin-6-id-2-yl]methoxy-methylphosphoryl]-6-methylmorpholin-2-yl]methoxy-methylphosphoryl]-6-methylmorpholin-2-yl]methoxy-methylphosphoryl]-N-methylmethanamine;yttrium with MolForge

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Related Compounds

2-[[3,4,4a,5,6,7,8,8a-octahydro-1H-isoquinolin-2-yl(methyl)phosphoryl]oxymethyl]-4,6-dimethylmorpholine
CID 158824777
[1-[(4,6-dimethylmorpholin-2-yl)methoxy-methylphosphoryl]piperidin-4-yl]-trimethylazanium
CID 161302078
N-[(4,6-dimethylmorpholin-2-yl)methoxy-[2-methyl-6-(2-methylpropyl)morpholin-4-yl]phosphoryl]-N-methylmethanamine
CID 135178519
dimethylamino-[[(2S)-4-[dimethylamino-[[(2S,6S)-6-methylmorpholin-2-yl]methoxy]phosphoryl]morpholin-2-yl]methoxy]-oxophosphanium;ethane;N-methyl-N-[methyl-[[(2S)-4-methylmorpholin-2-yl]methoxy]phosphoryl]methanamine
CID 155701017
CID 158444799
CID 158444799
ethane;2-[2-(2-hydroxyethoxy)ethoxy]ethyl 4-[dimethylamino-[[(2S)-4,6-dimethylmorpholin-2-yl]methoxy]phosphoryl]piperazine-1-carboxylate
CID 155701015
N-[[2-(methoxymethyl)morpholin-4-yl]-[(4-methylmorpholin-2-yl)methoxy]phosphoryl]-N-methylmethanamine
CID 10383294
CID 177077919
CID 177077919
2-(4,6-dimethylmorpholin-2-yl)ethyl-(2-ethyl-6-methylmorpholin-4-yl)-methyl-methylidene-λ5-phosphane
CID 20770203
2-[2-(2-hydroxyethoxy)ethoxy]ethyl 4-[dimethylamino-[[(2S,6S)-4-[dimethylamino-[[(2S,6S)-6-methylmorpholin-2-yl]methoxy]phosphoryl]-6-methylmorpholin-2-yl]methoxy]phosphoryl]piperazine-1-carboxylate
CID 149418489
CID 158857904
CID 158857904
dimethylamino-[[(2S,6S)-4-[dimethylamino-[[(2S,6R)-6-methoxymorpholin-2-yl]methoxy]phosphoryl]-6-methylmorpholin-2-yl]methoxy]-oxophosphanium;ethane
CID 155701013

Frequently Asked Questions

What is the IUPAC name of N-[[(2S,6S)-4-[[(2S,6S)-4-[[(2S)-4-[[(2S,6R)-4-[[(2S,6S)-4-[[(2S,6S)-4-[[(2S,6S)-4,6-dimethylmorpholin-2-yl]methoxy-methylphosphoryl]-6-tritiomorpholin-2-yl]methoxy-methylphosphoryl]-6-methylmorpholin-2-yl]methoxy-methylphosphoryl]-6-tritiomorpholin-2-yl]methoxy-methylphosphoryl]morpholin-6-id-2-yl]methoxy-methylphosphoryl]-6-methylmorpholin-2-yl]methoxy-methylphosphoryl]-6-methylmorpholin-2-yl]methoxy-methylphosphoryl]-N-methylmethanamine;yttrium?
The IUPAC name of N-[[(2S,6S)-4-[[(2S,6S)-4-[[(2S)-4-[[(2S,6R)-4-[[(2S,6S)-4-[[(2S,6S)-4-[[(2S,6S)-4,6-dimethylmorpholin-2-yl]methoxy-methylphosphoryl]-6-tritiomorpholin-2-yl]methoxy-methylphosphoryl]-6-methylmorpholin-2-yl]methoxy-methylphosphoryl]-6-tritiomorpholin-2-yl]methoxy-methylphosphoryl]morpholin-6-id-2-yl]methoxy-methylphosphoryl]-6-methylmorpholin-2-yl]methoxy-methylphosphoryl]-6-methylmorpholin-2-yl]methoxy-methylphosphoryl]-N-methylmethanamine;yttrium (CID 160658096) is N-[[(2S,6S)-4-[[(2S,6S)-4-[[(2S)-4-[[(2S,6R)-4-[[(2S,6S)-4-[[(2S,6S)-4-[[(2S,6S)-4,6-dimethylmorpholin-2-yl]methoxy-methylphosphoryl]-6-tritiomorpholin-2-yl]methoxy-methylphosphoryl]-6-methylmorpholin-2-yl]methoxy-methylphosphoryl]-6-tritiomorpholin-2-yl]methoxy-methylphosphoryl]morpholin-6-id-2-yl]methoxy-methylphosphoryl]-6-methylmorpholin-2-yl]methoxy-methylphosphoryl]-6-methylmorpholin-2-yl]methoxy-methylphosphoryl]-N-methylmethanamine;yttrium.
What is the SMILES notation for N-[[(2S,6S)-4-[[(2S,6S)-4-[[(2S)-4-[[(2S,6R)-4-[[(2S,6S)-4-[[(2S,6S)-4-[[(2S,6S)-4,6-dimethylmorpholin-2-yl]methoxy-methylphosphoryl]-6-tritiomorpholin-2-yl]methoxy-methylphosphoryl]-6-methylmorpholin-2-yl]methoxy-methylphosphoryl]-6-tritiomorpholin-2-yl]methoxy-methylphosphoryl]morpholin-6-id-2-yl]methoxy-methylphosphoryl]-6-methylmorpholin-2-yl]methoxy-methylphosphoryl]-6-methylmorpholin-2-yl]methoxy-methylphosphoryl]-N-methylmethanamine;yttrium?
The canonical SMILES for N-[[(2S,6S)-4-[[(2S,6S)-4-[[(2S)-4-[[(2S,6R)-4-[[(2S,6S)-4-[[(2S,6S)-4-[[(2S,6S)-4,6-dimethylmorpholin-2-yl]methoxy-methylphosphoryl]-6-tritiomorpholin-2-yl]methoxy-methylphosphoryl]-6-methylmorpholin-2-yl]methoxy-methylphosphoryl]-6-tritiomorpholin-2-yl]methoxy-methylphosphoryl]morpholin-6-id-2-yl]methoxy-methylphosphoryl]-6-methylmorpholin-2-yl]methoxy-methylphosphoryl]-6-methylmorpholin-2-yl]methoxy-methylphosphoryl]-N-methylmethanamine;yttrium is [3H][C@@H]1CN(P(C)(=O)OC[C@@H]2CN(P(C)(=O)OC[C@@H]3CN(P(C)(=O)OC[C@@H]4CN(C)C[C@H](C)O4)C[C@H]([3H])O3)C[C@H](C)O2)C[C@@H](COP(C)(=O)N2C[CH-]O[C@H](COP(C)(=O)N3C[C@@H](COP(C)(=O)N4C[C@@H](COP(C)(=O)N(C)C)O[C@@H](C)C4)O[C@@H](C)C3)C2)O1.[Y].
What is the InChIKey of N-[[(2S,6S)-4-[[(2S,6S)-4-[[(2S)-4-[[(2S,6R)-4-[[(2S,6S)-4-[[(2S,6S)-4-[[(2S,6S)-4,6-dimethylmorpholin-2-yl]methoxy-methylphosphoryl]-6-tritiomorpholin-2-yl]methoxy-methylphosphoryl]-6-methylmorpholin-2-yl]methoxy-methylphosphoryl]-6-tritiomorpholin-2-yl]methoxy-methylphosphoryl]morpholin-6-id-2-yl]methoxy-methylphosphoryl]-6-methylmorpholin-2-yl]methoxy-methylphosphoryl]-6-methylmorpholin-2-yl]methoxy-methylphosphoryl]-N-methylmethanamine;yttrium?
The InChIKey is FOOGAUPRZXFDAT-GUFHRCFGSA-N. The full InChI is InChI=1S/C49H100N8O21P7.Y/c1-39-21-51(7)25-46(75-39)35-72-81(10,60)53-16-20-67-45(28-53)34-71-83(12,62)55-22-41(3)77-48(30-55)37-73-82(11,61)54-17-19-65-43(26-54)32-69-80(9,59)52-15-18-66-44(27-52)33-70-84(13,63)56-23-42(4)78-49(31-56)38-74-85(14,64)57-24-40(2)76-47(29-57)36-68-79(8,58)50(5)6;/h18,39-49H,15-17,19-38H2,1-14H3;/q-1;/t39-,40-,41-,42-,43-,44-,45-,46-,47-,48-,49-,79?,80?,81?,82?,83?,84?,85?;/m0./s1/i19T,20T;/t19-,20+,39+,40+,41+,42+,43+,44+,45+,46+,47+,48+,49+,79?,80?,81?,82?,83?,84?,85?;/m1..
What are the key properties of N-[[(2S,6S)-4-[[(2S,6S)-4-[[(2S)-4-[[(2S,6R)-4-[[(2S,6S)-4-[[(2S,6S)-4-[[(2S,6S)-4,6-dimethylmorpholin-2-yl]methoxy-methylphosphoryl]-6-tritiomorpholin-2-yl]methoxy-methylphosphoryl]-6-methylmorpholin-2-yl]methoxy-methylphosphoryl]-6-tritiomorpholin-2-yl]methoxy-methylphosphoryl]morpholin-6-id-2-yl]methoxy-methylphosphoryl]-6-methylmorpholin-2-yl]methoxy-methylphosphoryl]-6-methylmorpholin-2-yl]methoxy-methylphosphoryl]-N-methylmethanamine;yttrium?
N-[[(2S,6S)-4-[[(2S,6S)-4-[[(2S)-4-[[(2S,6R)-4-[[(2S,6S)-4-[[(2S,6S)-4-[[(2S,6S)-4,6-dimethylmorpholin-2-yl]methoxy-methylphosphoryl]-6-tritiomorpholin-2-yl]methoxy-methylphosphoryl]-6-methylmorpholin-2-yl]methoxy-methylphosphoryl]-6-tritiomorpholin-2-yl]methoxy-methylphosphoryl]morpholin-6-id-2-yl]methoxy-methylphosphoryl]-6-methylmorpholin-2-yl]methoxy-methylphosphoryl]-6-methylmorpholin-2-yl]methoxy-methylphosphoryl]-N-methylmethanamine;yttrium has a molecular weight of 1447.11 g/mol, XLogP of 5.67, 28 rotatable bonds, 0 hydrogen bond donors, and 22 hydrogen bond acceptors.
Where does this data come from?
All data for N-[[(2S,6S)-4-[[(2S,6S)-4-[[(2S)-4-[[(2S,6R)-4-[[(2S,6S)-4-[[(2S,6S)-4-[[(2S,6S)-4,6-dimethylmorpholin-2-yl]methoxy-methylphosphoryl]-6-tritiomorpholin-2-yl]methoxy-methylphosphoryl]-6-methylmorpholin-2-yl]methoxy-methylphosphoryl]-6-tritiomorpholin-2-yl]methoxy-methylphosphoryl]morpholin-6-id-2-yl]methoxy-methylphosphoryl]-6-methylmorpholin-2-yl]methoxy-methylphosphoryl]-6-methylmorpholin-2-yl]methoxy-methylphosphoryl]-N-methylmethanamine;yttrium is sourced from PubChem (CID 160658096), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).