[(2R,3R,5S)-2-(aminomethyl)-5-methyl-2-(propan-2-yloxymethyl)oxolan-3-yl] 1-[(2S,3R,5S)-5-methyl-3-propan-2-yloxyoxolan-2-yl]ethenyl phosphate;[(1R,2S,4R)-2-amino-4-methyl-2-(propan-2-yloxymethyl)cyclopentyl] 1-[(2S,3R,5S)-5-methyl-3-propan-2-yloxyoxolan-2-yl]ethenyl phosphate;[(1R,2R,4S)-3-amino-4-methyl-2-(propan-2-yloxymethyl)cyclopentyl] 1-[(2S,3R,5S)-5-methyl-3-propan-2-yloxyoxolan-2-yl]ethenyl phosphate;[(2R,3R,5S)-4-amino-5-methyl-2-(propan-2-yloxymethyl)oxolan-3-yl] 1-[(2S,3R,5S)-5-methyl-3-propan-2-yloxyoxolan-2-yl]ethenyl phosphate

C79H146N4O30P4-4 — CID 159625389

About [(2R,3R,5S)-2-(aminomethyl)-5-methyl-2-(propan-2-yloxymethyl)oxolan-3-yl] 1-[(2S,3R,5S)-5-methyl-3-propan-2-yloxyoxolan-2-yl]ethenyl phosphate;[(1R,2S,4R)-2-amino-4-methyl-2-(propan-2-yloxymethyl)cyclopentyl] 1-[(2S,3R,5S)-5-methyl-3-propan-2-yloxyoxolan-2-yl]ethenyl phosphate;[(1R,2R,4S)-3-amino-4-methyl-2-(propan-2-yloxymethyl)cyclopentyl] 1-[(2S,3R,5S)-5-methyl-3-propan-2-yloxyoxolan-2-yl]ethenyl phosphate;[(2R,3R,5S)-4-amino-5-methyl-2-(propan-2-yloxymethyl)oxolan-3-yl] 1-[(2S,3R,5S)-5-methyl-3-propan-2-yloxyoxolan-2-yl]ethenyl phosphate

[(2R,3R,5S)-2-(aminomethyl)-5-methyl-2-(propan-2-yloxymethyl)oxolan-3-yl] 1-[(2S,3R,5S)-5-methyl-3-propan-2-yloxyoxolan-2-yl]ethenyl phosphate;[(1R,2S,4R)-2-amino-4-methyl-2-(propan-2-yloxymethyl)cyclopentyl] 1-[(2S,3R,5S)-5-methyl-3-propan-2-yloxyoxolan-2-yl]ethenyl phosphate;[(1R,2R,4S)-3-amino-4-methyl-2-(propan-2-yloxymethyl)cyclopentyl] 1-[(2S,3R,5S)-5-methyl-3-propan-2-yloxyoxolan-2-yl]ethenyl phosphate;[(2R,3R,5S)-4-amino-5-methyl-2-(propan-2-yloxymethyl)oxolan-3-yl] 1-[(2S,3R,5S)-5-methyl-3-propan-2-yloxyoxolan-2-yl]ethenyl phosphate (PubChem CID 159625389) has the molecular formula C79H146N4O30P4-4 and a molecular weight of 1755.93 g/mol. Its IUPAC name is [(2R,3R,5S)-2-(aminomethyl)-5-methyl-2-(propan-2-yloxymethyl)oxolan-3-yl] 1-[(2S,3R,5S)-5-methyl-3-propan-2-yloxyoxolan-2-yl]ethenyl phosphate;[(1R,2S,4R)-2-amino-4-methyl-2-(propan-2-yloxymethyl)cyclopentyl] 1-[(2S,3R,5S)-5-methyl-3-propan-2-yloxyoxolan-2-yl]ethenyl phosphate;[(1R,2R,4S)-3-amino-4-methyl-2-(propan-2-yloxymethyl)cyclopentyl] 1-[(2S,3R,5S)-5-methyl-3-propan-2-yloxyoxolan-2-yl]ethenyl phosphate;[(2R,3R,5S)-4-amino-5-methyl-2-(propan-2-yloxymethyl)oxolan-3-yl] 1-[(2S,3R,5S)-5-methyl-3-propan-2-yloxyoxolan-2-yl]ethenyl phosphate.

Molecular Properties

• Compound Name: [(2R,3R,5S)-2-(aminomethyl)-5-methyl-2-(propan-2-yloxymethyl)oxolan-3-yl] 1-[(2S,3R,5S)-5-methyl-3-propan-2-yloxyoxolan-2-yl]ethenyl phosphate;[(1R,2S,4R)-2-amino-4-methyl-2-(propan-2-yloxymethyl)cyclopentyl] 1-[(2S,3R,5S)-5-methyl-3-propan-2-yloxyoxolan-2-yl]ethenyl phosphate;[(1R,2R,4S)-3-amino-4-methyl-2-(propan-2-yloxymethyl)cyclopentyl] 1-[(2S,3R,5S)-5-methyl-3-propan-2-yloxyoxolan-2-yl]ethenyl phosphate;[(2R,3R,5S)-4-amino-5-methyl-2-(propan-2-yloxymethyl)oxolan-3-yl] 1-[(2S,3R,5S)-5-methyl-3-propan-2-yloxyoxolan-2-yl]ethenyl phosphate
• PubChem CID: 159625389
• Molecular Formula: C79H146N4O30P4-4
• Molecular Weight: 1755.93 g/mol
• Exact Mass: 1754.90
• IUPAC Name: [(2R,3R,5S)-2-(aminomethyl)-5-methyl-2-(propan-2-yloxymethyl)oxolan-3-yl] 1-[(2S,3R,5S)-5-methyl-3-propan-2-yloxyoxolan-2-yl]ethenyl phosphate;[(1R,2S,4R)-2-amino-4-methyl-2-(propan-2-yloxymethyl)cyclopentyl] 1-[(2S,3R,5S)-5-methyl-3-propan-2-yloxyoxolan-2-yl]ethenyl phosphate;[(1R,2R,4S)-3-amino-4-methyl-2-(propan-2-yloxymethyl)cyclopentyl] 1-[(2S,3R,5S)-5-methyl-3-propan-2-yloxyoxolan-2-yl]ethenyl phosphate;[(2R,3R,5S)-4-amino-5-methyl-2-(propan-2-yloxymethyl)oxolan-3-yl] 1-[(2S,3R,5S)-5-methyl-3-propan-2-yloxyoxolan-2-yl]ethenyl phosphate
• SMILES: C=C(OP(=O)([O-])O[C@@H]1C(N)[C@H](C)O[C@@H]1COC(C)C)[C@H]1O[C@@H](C)C[C@H]1OC(C)C.C=C(OP(=O)([O-])O[C@@H]1C[C@H](C)C(N)[C@@H]1COC(C)C)[C@H]1O[C@@H](C)C[C@H]1OC(C)C.C=C(OP(=O)([O-])O[C@@H]1C[C@H](C)C[C@]1(N)COC(C)C)[C@H]1O[C@@H](C)C[C@H]1OC(C)C.C=C(OP(=O)([O-])O[C@@H]1C[C@H](C)O[C@]1(CN)COC(C)C)[C@H]1O[C@@H](C)C[C@H]1OC(C)C
• InChI: InChI=1S/C20H38NO8P.2C20H38NO7P.C19H36NO8P/c1-12(2)24-11-20(10-21)18(9-15(6)27-20)29-30(22,23)28-16(7)19-17(25-13(3)4)8-14(5)26-19;1-12(2)24-11-20(21)10-14(5)8-18(20)28-29(22,23)27-16(7)19-17(25-13(3)4)9-15(6)26-19;1-11(2)24-10-16-17(8-13(5)19(16)21)28-29(22,23)27-15(7)20-18(25-12(3)4)9-14(6)26-20;1-10(2)23-9-16-19(17(20)13(6)26-16)28-29(21,22)27-14(7)18-15(24-11(3)4)8-12(5)25-18/h12-15,17-19H,7-11,21H2,1-6H3,(H,22,23);12-15,17-19H,7-11,21H2,1-6H3,(H,22,23);11-14,16-20H,7-10,21H2,1-6H3,(H,22,23);10-13,15-19H,7-9,20H2,1-6H3,(H,21,22)/p-4/t14-,15-,17+,18+,19+,20+;14-,15-,17+,18+,19+,20-;13-,14-,16+,17+,18+,19?,20+;12-,13-,15+,16+,17?,18+,19-/m0000/s1
• InChIKey: MOKNOYZRIHAPKD-ZNOWXRCESA-J
• XLogP: 9.80
• TPSA: 467.66 Ų
• H-Bond Donors: 4
• H-Bond Acceptors: 34
• Rotatable Bonds: 41
• Heavy Atoms: 117
• Complexity: —

Lipinski Rule of Five

3 violations

Rule	Value
MW ≤ 500	1755.93
LogP ≤ 5	9.80
H-Bond Donors ≤ 5	4
H-Bond Acceptors ≤ 10	34

Computed Properties (RDKit)

• Structural Alerts: {'alert_name': 'acyclic_C=C-O', 'substructure': 'N/A'}, {'alert_name': 'phosphor', 'substructure': 'N/A'}

Frequently Asked Questions

What is the IUPAC name of [(2R,3R,5S)-2-(aminomethyl)-5-methyl-2-(propan-2-yloxymethyl)oxolan-3-yl] 1-[(2S,3R,5S)-5-methyl-3-propan-2-yloxyoxolan-2-yl]ethenyl phosphate;[(1R,2S,4R)-2-amino-4-methyl-2-(propan-2-yloxymethyl)cyclopentyl] 1-[(2S,3R,5S)-5-methyl-3-propan-2-yloxyoxolan-2-yl]ethenyl phosphate;[(1R,2R,4S)-3-amino-4-methyl-2-(propan-2-yloxymethyl)cyclopentyl] 1-[(2S,3R,5S)-5-methyl-3-propan-2-yloxyoxolan-2-yl]ethenyl phosphate;[(2R,3R,5S)-4-amino-5-methyl-2-(propan-2-yloxymethyl)oxolan-3-yl] 1-[(2S,3R,5S)-5-methyl-3-propan-2-yloxyoxolan-2-yl]ethenyl phosphate?

The IUPAC name of [(2R,3R,5S)-2-(aminomethyl)-5-methyl-2-(propan-2-yloxymethyl)oxolan-3-yl] 1-[(2S,3R,5S)-5-methyl-3-propan-2-yloxyoxolan-2-yl]ethenyl phosphate;[(1R,2S,4R)-2-amino-4-methyl-2-(propan-2-yloxymethyl)cyclopentyl] 1-[(2S,3R,5S)-5-methyl-3-propan-2-yloxyoxolan-2-yl]ethenyl phosphate;[(1R,2R,4S)-3-amino-4-methyl-2-(propan-2-yloxymethyl)cyclopentyl] 1-[(2S,3R,5S)-5-methyl-3-propan-2-yloxyoxolan-2-yl]ethenyl phosphate;[(2R,3R,5S)-4-amino-5-methyl-2-(propan-2-yloxymethyl)oxolan-3-yl] 1-[(2S,3R,5S)-5-methyl-3-propan-2-yloxyoxolan-2-yl]ethenyl phosphate (CID 159625389) is [(2R,3R,5S)-2-(aminomethyl)-5-methyl-2-(propan-2-yloxymethyl)oxolan-3-yl] 1-[(2S,3R,5S)-5-methyl-3-propan-2-yloxyoxolan-2-yl]ethenyl phosphate;[(1R,2S,4R)-2-amino-4-methyl-2-(propan-2-yloxymethyl)cyclopentyl] 1-[(2S,3R,5S)-5-methyl-3-propan-2-yloxyoxolan-2-yl]ethenyl phosphate;[(1R,2R,4S)-3-amino-4-methyl-2-(propan-2-yloxymethyl)cyclopentyl] 1-[(2S,3R,5S)-5-methyl-3-propan-2-yloxyoxolan-2-yl]ethenyl phosphate;[(2R,3R,5S)-4-amino-5-methyl-2-(propan-2-yloxymethyl)oxolan-3-yl] 1-[(2S,3R,5S)-5-methyl-3-propan-2-yloxyoxolan-2-yl]ethenyl phosphate.

What is the SMILES notation for [(2R,3R,5S)-2-(aminomethyl)-5-methyl-2-(propan-2-yloxymethyl)oxolan-3-yl] 1-[(2S,3R,5S)-5-methyl-3-propan-2-yloxyoxolan-2-yl]ethenyl phosphate;[(1R,2S,4R)-2-amino-4-methyl-2-(propan-2-yloxymethyl)cyclopentyl] 1-[(2S,3R,5S)-5-methyl-3-propan-2-yloxyoxolan-2-yl]ethenyl phosphate;[(1R,2R,4S)-3-amino-4-methyl-2-(propan-2-yloxymethyl)cyclopentyl] 1-[(2S,3R,5S)-5-methyl-3-propan-2-yloxyoxolan-2-yl]ethenyl phosphate;[(2R,3R,5S)-4-amino-5-methyl-2-(propan-2-yloxymethyl)oxolan-3-yl] 1-[(2S,3R,5S)-5-methyl-3-propan-2-yloxyoxolan-2-yl]ethenyl phosphate?

The canonical SMILES for [(2R,3R,5S)-2-(aminomethyl)-5-methyl-2-(propan-2-yloxymethyl)oxolan-3-yl] 1-[(2S,3R,5S)-5-methyl-3-propan-2-yloxyoxolan-2-yl]ethenyl phosphate;[(1R,2S,4R)-2-amino-4-methyl-2-(propan-2-yloxymethyl)cyclopentyl] 1-[(2S,3R,5S)-5-methyl-3-propan-2-yloxyoxolan-2-yl]ethenyl phosphate;[(1R,2R,4S)-3-amino-4-methyl-2-(propan-2-yloxymethyl)cyclopentyl] 1-[(2S,3R,5S)-5-methyl-3-propan-2-yloxyoxolan-2-yl]ethenyl phosphate;[(2R,3R,5S)-4-amino-5-methyl-2-(propan-2-yloxymethyl)oxolan-3-yl] 1-[(2S,3R,5S)-5-methyl-3-propan-2-yloxyoxolan-2-yl]ethenyl phosphate is C=C(OP(=O)([O-])O[C@@H]1C(N)[C@H](C)O[C@@H]1COC(C)C)[C@H]1O[C@@H](C)C[C@H]1OC(C)C.C=C(OP(=O)([O-])O[C@@H]1C[C@H](C)C(N)[C@@H]1COC(C)C)[C@H]1O[C@@H](C)C[C@H]1OC(C)C.C=C(OP(=O)([O-])O[C@@H]1C[C@H](C)C[C@]1(N)COC(C)C)[C@H]1O[C@@H](C)C[C@H]1OC(C)C.C=C(OP(=O)([O-])O[C@@H]1C[C@H](C)O[C@]1(CN)COC(C)C)[C@H]1O[C@@H](C)C[C@H]1OC(C)C.

What is the InChIKey of [(2R,3R,5S)-2-(aminomethyl)-5-methyl-2-(propan-2-yloxymethyl)oxolan-3-yl] 1-[(2S,3R,5S)-5-methyl-3-propan-2-yloxyoxolan-2-yl]ethenyl phosphate;[(1R,2S,4R)-2-amino-4-methyl-2-(propan-2-yloxymethyl)cyclopentyl] 1-[(2S,3R,5S)-5-methyl-3-propan-2-yloxyoxolan-2-yl]ethenyl phosphate;[(1R,2R,4S)-3-amino-4-methyl-2-(propan-2-yloxymethyl)cyclopentyl] 1-[(2S,3R,5S)-5-methyl-3-propan-2-yloxyoxolan-2-yl]ethenyl phosphate;[(2R,3R,5S)-4-amino-5-methyl-2-(propan-2-yloxymethyl)oxolan-3-yl] 1-[(2S,3R,5S)-5-methyl-3-propan-2-yloxyoxolan-2-yl]ethenyl phosphate?

The InChIKey is MOKNOYZRIHAPKD-ZNOWXRCESA-J. The full InChI is InChI=1S/C20H38NO8P.2C20H38NO7P.C19H36NO8P/c1-12(2)24-11-20(10-21)18(9-15(6)27-20)29-30(22,23)28-16(7)19-17(25-13(3)4)8-14(5)26-19;1-12(2)24-11-20(21)10-14(5)8-18(20)28-29(22,23)27-16(7)19-17(25-13(3)4)9-15(6)26-19;1-11(2)24-10-16-17(8-13(5)19(16)21)28-29(22,23)27-15(7)20-18(25-12(3)4)9-14(6)26-20;1-10(2)23-9-16-19(17(20)13(6)26-16)28-29(21,22)27-14(7)18-15(24-11(3)4)8-12(5)25-18/h12-15,17-19H,7-11,21H2,1-6H3,(H,22,23);12-15,17-19H,7-11,21H2,1-6H3,(H,22,23);11-14,16-20H,7-10,21H2,1-6H3,(H,22,23);10-13,15-19H,7-9,20H2,1-6H3,(H,21,22)/p-4/t14-,15-,17+,18+,19+,20+;14-,15-,17+,18+,19+,20-;13-,14-,16+,17+,18+,19?,20+;12-,13-,15+,16+,17?,18+,19-/m0000/s1.

What are the key properties of [(2R,3R,5S)-2-(aminomethyl)-5-methyl-2-(propan-2-yloxymethyl)oxolan-3-yl] 1-[(2S,3R,5S)-5-methyl-3-propan-2-yloxyoxolan-2-yl]ethenyl phosphate;[(1R,2S,4R)-2-amino-4-methyl-2-(propan-2-yloxymethyl)cyclopentyl] 1-[(2S,3R,5S)-5-methyl-3-propan-2-yloxyoxolan-2-yl]ethenyl phosphate;[(1R,2R,4S)-3-amino-4-methyl-2-(propan-2-yloxymethyl)cyclopentyl] 1-[(2S,3R,5S)-5-methyl-3-propan-2-yloxyoxolan-2-yl]ethenyl phosphate;[(2R,3R,5S)-4-amino-5-methyl-2-(propan-2-yloxymethyl)oxolan-3-yl] 1-[(2S,3R,5S)-5-methyl-3-propan-2-yloxyoxolan-2-yl]ethenyl phosphate?

[(2R,3R,5S)-2-(aminomethyl)-5-methyl-2-(propan-2-yloxymethyl)oxolan-3-yl] 1-[(2S,3R,5S)-5-methyl-3-propan-2-yloxyoxolan-2-yl]ethenyl phosphate;[(1R,2S,4R)-2-amino-4-methyl-2-(propan-2-yloxymethyl)cyclopentyl] 1-[(2S,3R,5S)-5-methyl-3-propan-2-yloxyoxolan-2-yl]ethenyl phosphate;[(1R,2R,4S)-3-amino-4-methyl-2-(propan-2-yloxymethyl)cyclopentyl] 1-[(2S,3R,5S)-5-methyl-3-propan-2-yloxyoxolan-2-yl]ethenyl phosphate;[(2R,3R,5S)-4-amino-5-methyl-2-(propan-2-yloxymethyl)oxolan-3-yl] 1-[(2S,3R,5S)-5-methyl-3-propan-2-yloxyoxolan-2-yl]ethenyl phosphate has a molecular weight of 1755.93 g/mol, XLogP of 9.80, 41 rotatable bonds, 4 hydrogen bond donors, and 34 hydrogen bond acceptors.

Where does this data come from?

All data for [(2R,3R,5S)-2-(aminomethyl)-5-methyl-2-(propan-2-yloxymethyl)oxolan-3-yl] 1-[(2S,3R,5S)-5-methyl-3-propan-2-yloxyoxolan-2-yl]ethenyl phosphate;[(1R,2S,4R)-2-amino-4-methyl-2-(propan-2-yloxymethyl)cyclopentyl] 1-[(2S,3R,5S)-5-methyl-3-propan-2-yloxyoxolan-2-yl]ethenyl phosphate;[(1R,2R,4S)-3-amino-4-methyl-2-(propan-2-yloxymethyl)cyclopentyl] 1-[(2S,3R,5S)-5-methyl-3-propan-2-yloxyoxolan-2-yl]ethenyl phosphate;[(2R,3R,5S)-4-amino-5-methyl-2-(propan-2-yloxymethyl)oxolan-3-yl] 1-[(2S,3R,5S)-5-methyl-3-propan-2-yloxyoxolan-2-yl]ethenyl phosphate is sourced from PubChem (CID 159625389), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).