bis[bis[bis(phosphanyl)phosphanyl]phosphanyl]-[bis[bis(phosphanyl)phosphanyl]phosphanyl-[bis[bis(phosphanyl)phosphanyl]phosphanyl-[bis(phosphanyl)phosphanyl-(diphosphanyl)phosphanyl]phosphanyl]phosphanyl]phosphane;bis[bis[bis(phosphanyl)phosphanyl]phosphanyl]-[bis[bis(phosphanyl)phosphanyl]phosphanyl-[bis[bis(phosphanyl)phosphanyl]phosphanyl-[bis(phosphanyl)phosphanyl-phosphanylphosphanyl]phosphanyl]phosphanyl]phosphane;(1S,2E,4S,5S,9R,12R,14S)-9-[tert-butyl(dimethyl)silyl]oxy-5-[(2E,4E,6S)-7-[(2R,3R)-3-[(2S,3S)-3-[diethyl(propan-2-yl)silyl]oxypentan-2-yl]oxiran-2-yl]-6-methylhepta-2,4-dien-2-yl]-4,12-dimethyl-14-phenyl-6,13,15-trioxabicyclo[10.3.0]pentadec-2-en-7-one;(1S,2E,4S,5S,9R,12R,14S)-9-hydroxy-5-[(2E,4E,6S)-7-[(2R,3R)-3-[(2R,3S)-3-hydroxypentan-2-yl]oxiran-2-yl]-6-methylhepta-2,4-dien-2-yl]-4,12-dimethyl-14-phenyl-6,13,15-trioxabicyclo[10.3.0]pentadec-2-en-7-one

C83H207O14P73Si2 — CID 158459067

IUPACbis[bis[bis(phosphanyl)phosphanyl]phosphanyl]-[bis[bis(phosphanyl)phosphanyl]phosphanyl-[bis[bis(phosphanyl)phosphanyl]phosphanyl-[bis(phosphanyl)phosphanyl-(diphosphanyl)phosphanyl]phosphanyl]phosphanyl]phosphane;bis[bis[bis(phosphanyl)phosphanyl]phosphanyl]-[bis[bis(phosphanyl)phosphanyl]phosphanyl-[bis[bis(phosphanyl)phosphanyl]phosphanyl-[bis(phosphanyl)phosphanyl-phosphanylphosphanyl]phosphanyl]phosphanyl]phosphane;(1S,2E,4S,5S,9R,12R,14S)-9-[tert-butyl(dimethyl)silyl]oxy-5-[(2E,4E,6S)-7-[(2R,3R)-3-[(2S,3S)-3-[diethyl(propan-2-yl)silyl]oxypentan-2-yl]oxiran-2-yl]-6-methylhepta-2,4-dien-2-yl]-4,12-dimethyl-14-phenyl-6,13,15-trioxabicyclo[10.3.0]pentadec-2-en-7-one;(1S,2E,4S,5S,9R,12R,14S)-9-hydroxy-5-[(2E,4E,6S)-7-[(2R,3R)-3-[(2R,3S)-3-hydroxypentan-2-yl]oxiran-2-yl]-6-methylhepta-2,4-dien-2-yl]-4,12-dimethyl-14-phenyl-6,13,15-trioxabicyclo[10.3.0]pentadec-2-en-7-one
SMILESCC[C@H](O)[C@@H](C)[C@H]1O[C@@H]1C[C@H](C)/C=C/C=C(\C)[C@H]1OC(=O)C[C@H](O)CC[C@@]2(C)O[C@@H](c3ccccc3)O[C@H]2/C=C/[C@@H]1C.CC[C@H](O[Si](CC)(CC)C(C)C)[C@@H](C)[C@H]1O[C@@H]1C[C@H](C)/C=C/C=C(\C)[C@H]1OC(=O)C[C@H](O[Si](C)(C)C(C)(C)C)CC[C@@]2(C)O[C@@H](c3ccccc3)O[C@H]2/C=C/[C@@H]1C.PP(P)P(P)P(P(P(P)P)P(P)P)P(P(P(P)P)P(P)P)P(P(P(P)P)P(P)P)P(P(P)P)P(P)P.PPP(P(P)P)P(P(P(P)P)P(P)P)P(P(P(P)P)P(P)P)P(P(P(P)P)P(P)P)P(P(P)P)P(P)P
InChIInChI=1S/C48H80O7Si2.C35H50O7.H39P37.H38P36/c1-16-40(55-57(17-2,18-3)33(4)5)37(9)45-41(50-45)31-34(6)23-22-24-35(7)44-36(8)27-28-42-48(13,53-46(51-42)38-25-20-19-21-26-38)30-29-39(32-43(49)52-44)54-56(14,15)47(10,11)12;1-7-28(37)25(5)33-29(39-33)20-22(2)12-11-13-23(3)32-24(4)16-17-30-35(6,19-18-27(36)21-31(38)41-32)42-34(40-30)26-14-9-8-10-15-26;1-20-30(21(2)3)35(31(22(4)5)23(6)7)37(34(28(16)17)29(18)19)36(32(24(8)9)25(10)11)33(26(12)13)27(14)15;1-20(2)29(19)34(30(21(3)4)22(5)6)36(33(27(15)16)28(17)18)35(31(23(7)8)24(9)10)32(25(11)12)26(13)14/h19-28,33-34,36-37,39-42,44-46H,16-18,29-32H2,1-15H3;8-17,22,24-25,27-30,32-34,36-37H,7,18-21H2,1-6H3;20H,1-19H2;1-19H2/b23-22+,28-27+,35-24+;12-11+,17-16+,23-13+;;/t34-,36+,37-,39-,40+,41-,42+,44-,45-,46+,48-;22-,24+,25-,27-,28+,29-,30+,32-,33-,34+,35-;;/m11../s1
InChIKeyHEYAZBOURBMGCZ-YYIZVPMYSA-N
MW3746.83 g/mol
LogP61.13
Rot. Bonds58

About bis[bis[bis(phosphanyl)phosphanyl]phosphanyl]-[bis[bis(phosphanyl)phosphanyl]phosphanyl-[bis[bis(phosphanyl)phosphanyl]phosphanyl-[bis(phosphanyl)phosphanyl-(diphosphanyl)phosphanyl]phosphanyl]phosphanyl]phosphane;bis[bis[bis(phosphanyl)phosphanyl]phosphanyl]-[bis[bis(phosphanyl)phosphanyl]phosphanyl-[bis[bis(phosphanyl)phosphanyl]phosphanyl-[bis(phosphanyl)phosphanyl-phosphanylphosphanyl]phosphanyl]phosphanyl]phosphane;(1S,2E,4S,5S,9R,12R,14S)-9-[tert-butyl(dimethyl)silyl]oxy-5-[(2E,4E,6S)-7-[(2R,3R)-3-[(2S,3S)-3-[diethyl(propan-2-yl)silyl]oxypentan-2-yl]oxiran-2-yl]-6-methylhepta-2,4-dien-2-yl]-4,12-dimethyl-14-phenyl-6,13,15-trioxabicyclo[10.3.0]pentadec-2-en-7-one;(1S,2E,4S,5S,9R,12R,14S)-9-hydroxy-5-[(2E,4E,6S)-7-[(2R,3R)-3-[(2R,3S)-3-hydroxypentan-2-yl]oxiran-2-yl]-6-methylhepta-2,4-dien-2-yl]-4,12-dimethyl-14-phenyl-6,13,15-trioxabicyclo[10.3.0]pentadec-2-en-7-one

bis[bis[bis(phosphanyl)phosphanyl]phosphanyl]-[bis[bis(phosphanyl)phosphanyl]phosphanyl-[bis[bis(phosphanyl)phosphanyl]phosphanyl-[bis(phosphanyl)phosphanyl-(diphosphanyl)phosphanyl]phosphanyl]phosphanyl]phosphane;bis[bis[bis(phosphanyl)phosphanyl]phosphanyl]-[bis[bis(phosphanyl)phosphanyl]phosphanyl-[bis[bis(phosphanyl)phosphanyl]phosphanyl-[bis(phosphanyl)phosphanyl-phosphanylphosphanyl]phosphanyl]phosphanyl]phosphane;(1S,2E,4S,5S,9R,12R,14S)-9-[tert-butyl(dimethyl)silyl]oxy-5-[(2E,4E,6S)-7-[(2R,3R)-3-[(2S,3S)-3-[diethyl(propan-2-yl)silyl]oxypentan-2-yl]oxiran-2-yl]-6-methylhepta-2,4-dien-2-yl]-4,12-dimethyl-14-phenyl-6,13,15-trioxabicyclo[10.3.0]pentadec-2-en-7-one;(1S,2E,4S,5S,9R,12R,14S)-9-hydroxy-5-[(2E,4E,6S)-7-[(2R,3R)-3-[(2R,3S)-3-hydroxypentan-2-yl]oxiran-2-yl]-6-methylhepta-2,4-dien-2-yl]-4,12-dimethyl-14-phenyl-6,13,15-trioxabicyclo[10.3.0]pentadec-2-en-7-one (PubChem CID 158459067) has the molecular formula C83H207O14P73Si2 and a molecular weight of 3746.83 g/mol. Its IUPAC name is bis[bis[bis(phosphanyl)phosphanyl]phosphanyl]-[bis[bis(phosphanyl)phosphanyl]phosphanyl-[bis[bis(phosphanyl)phosphanyl]phosphanyl-[bis(phosphanyl)phosphanyl-(diphosphanyl)phosphanyl]phosphanyl]phosphanyl]phosphane;bis[bis[bis(phosphanyl)phosphanyl]phosphanyl]-[bis[bis(phosphanyl)phosphanyl]phosphanyl-[bis[bis(phosphanyl)phosphanyl]phosphanyl-[bis(phosphanyl)phosphanyl-phosphanylphosphanyl]phosphanyl]phosphanyl]phosphane;(1S,2E,4S,5S,9R,12R,14S)-9-[tert-butyl(dimethyl)silyl]oxy-5-[(2E,4E,6S)-7-[(2R,3R)-3-[(2S,3S)-3-[diethyl(propan-2-yl)silyl]oxypentan-2-yl]oxiran-2-yl]-6-methylhepta-2,4-dien-2-yl]-4,12-dimethyl-14-phenyl-6,13,15-trioxabicyclo[10.3.0]pentadec-2-en-7-one;(1S,2E,4S,5S,9R,12R,14S)-9-hydroxy-5-[(2E,4E,6S)-7-[(2R,3R)-3-[(2R,3S)-3-hydroxypentan-2-yl]oxiran-2-yl]-6-methylhepta-2,4-dien-2-yl]-4,12-dimethyl-14-phenyl-6,13,15-trioxabicyclo[10.3.0]pentadec-2-en-7-one.

Molecular Properties

Compound Namebis[bis[bis(phosphanyl)phosphanyl]phosphanyl]-[bis[bis(phosphanyl)phosphanyl]phosphanyl-[bis[bis(phosphanyl)phosphanyl]phosphanyl-[bis(phosphanyl)phosphanyl-(diphosphanyl)phosphanyl]phosphanyl]phosphanyl]phosphane;bis[bis[bis(phosphanyl)phosphanyl]phosphanyl]-[bis[bis(phosphanyl)phosphanyl]phosphanyl-[bis[bis(phosphanyl)phosphanyl]phosphanyl-[bis(phosphanyl)phosphanyl-phosphanylphosphanyl]phosphanyl]phosphanyl]phosphane;(1S,2E,4S,5S,9R,12R,14S)-9-[tert-butyl(dimethyl)silyl]oxy-5-[(2E,4E,6S)-7-[(2R,3R)-3-[(2S,3S)-3-[diethyl(propan-2-yl)silyl]oxypentan-2-yl]oxiran-2-yl]-6-methylhepta-2,4-dien-2-yl]-4,12-dimethyl-14-phenyl-6,13,15-trioxabicyclo[10.3.0]pentadec-2-en-7-one;(1S,2E,4S,5S,9R,12R,14S)-9-hydroxy-5-[(2E,4E,6S)-7-[(2R,3R)-3-[(2R,3S)-3-hydroxypentan-2-yl]oxiran-2-yl]-6-methylhepta-2,4-dien-2-yl]-4,12-dimethyl-14-phenyl-6,13,15-trioxabicyclo[10.3.0]pentadec-2-en-7-one
PubChem CID158459067
Molecular FormulaC83H207O14P73Si2
Molecular Weight3746.83 g/mol
Exact Mass3745.59
IUPAC Namebis[bis[bis(phosphanyl)phosphanyl]phosphanyl]-[bis[bis(phosphanyl)phosphanyl]phosphanyl-[bis[bis(phosphanyl)phosphanyl]phosphanyl-[bis(phosphanyl)phosphanyl-(diphosphanyl)phosphanyl]phosphanyl]phosphanyl]phosphane;bis[bis[bis(phosphanyl)phosphanyl]phosphanyl]-[bis[bis(phosphanyl)phosphanyl]phosphanyl-[bis[bis(phosphanyl)phosphanyl]phosphanyl-[bis(phosphanyl)phosphanyl-phosphanylphosphanyl]phosphanyl]phosphanyl]phosphane;(1S,2E,4S,5S,9R,12R,14S)-9-[tert-butyl(dimethyl)silyl]oxy-5-[(2E,4E,6S)-7-[(2R,3R)-3-[(2S,3S)-3-[diethyl(propan-2-yl)silyl]oxypentan-2-yl]oxiran-2-yl]-6-methylhepta-2,4-dien-2-yl]-4,12-dimethyl-14-phenyl-6,13,15-trioxabicyclo[10.3.0]pentadec-2-en-7-one;(1S,2E,4S,5S,9R,12R,14S)-9-hydroxy-5-[(2E,4E,6S)-7-[(2R,3R)-3-[(2R,3S)-3-hydroxypentan-2-yl]oxiran-2-yl]-6-methylhepta-2,4-dien-2-yl]-4,12-dimethyl-14-phenyl-6,13,15-trioxabicyclo[10.3.0]pentadec-2-en-7-one
SMILESCC[C@H](O)[C@@H](C)[C@H]1O[C@@H]1C[C@H](C)/C=C/C=C(\C)[C@H]1OC(=O)C[C@H](O)CC[C@@]2(C)O[C@@H](c3ccccc3)O[C@H]2/C=C/[C@@H]1C.CC[C@H](O[Si](CC)(CC)C(C)C)[C@@H](C)[C@H]1O[C@@H]1C[C@H](C)/C=C/C=C(\C)[C@H]1OC(=O)C[C@H](O[Si](C)(C)C(C)(C)C)CC[C@@]2(C)O[C@@H](c3ccccc3)O[C@H]2/C=C/[C@@H]1C.PP(P)P(P)P(P(P(P)P)P(P)P)P(P(P(P)P)P(P)P)P(P(P(P)P)P(P)P)P(P(P)P)P(P)P.PPP(P(P)P)P(P(P(P)P)P(P)P)P(P(P(P)P)P(P)P)P(P(P(P)P)P(P)P)P(P(P)P)P(P)P
InChIInChI=1S/C48H80O7Si2.C35H50O7.H39P37.H38P36/c1-16-40(55-57(17-2,18-3)33(4)5)37(9)45-41(50-45)31-34(6)23-22-24-35(7)44-36(8)27-28-42-48(13,53-46(51-42)38-25-20-19-21-26-38)30-29-39(32-43(49)52-44)54-56(14,15)47(10,11)12;1-7-28(37)25(5)33-29(39-33)20-22(2)12-11-13-23(3)32-24(4)16-17-30-35(6,19-18-27(36)21-31(38)41-32)42-34(40-30)26-14-9-8-10-15-26;1-20-30(21(2)3)35(31(22(4)5)23(6)7)37(34(28(16)17)29(18)19)36(32(24(8)9)25(10)11)33(26(12)13)27(14)15;1-20(2)29(19)34(30(21(3)4)22(5)6)36(33(27(15)16)28(17)18)35(31(23(7)8)24(9)10)32(25(11)12)26(13)14/h19-28,33-34,36-37,39-42,44-46H,16-18,29-32H2,1-15H3;8-17,22,24-25,27-30,32-34,36-37H,7,18-21H2,1-6H3;20H,1-19H2;1-19H2/b23-22+,28-27+,35-24+;12-11+,17-16+,23-13+;;/t34-,36+,37-,39-,40+,41-,42+,44-,45-,46+,48-;22-,24+,25-,27-,28+,29-,30+,32-,33-,34+,35-;;/m11../s1
InChIKeyHEYAZBOURBMGCZ-YYIZVPMYSA-N
XLogP61.13
TPSA173.50 Ų
H-Bond Donors2
H-Bond Acceptors14
Rotatable Bonds58
Heavy Atoms172
Complexity—

Lipinski Rule of Five

3 violations

RuleValue
MW ≤ 5003746.83
LogP ≤ 561.13
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 1014

Computed Properties (RDKit)

Structural Alerts{'alert_name': 'heavy_metal', 'substructure': 'N/A'}, {'alert_name': 'isolated_alkene', 'substructure': 'N/A'}, {'alert_name': 'phosphor', 'substructure': 'N/A'}, {'alert_name': 'polyene', 'substructure': 'N/A'}, {'alert_name': 'Three-membered_heterocycle', 'substructure': 'N/A'}

Analyze bis[bis[bis(phosphanyl)phosphanyl]phosphanyl]-[bis[bis(phosphanyl)phosphanyl]phosphanyl-[bis[bis(phosphanyl)phosphanyl]phosphanyl-[bis(phosphanyl)phosphanyl-(diphosphanyl)phosphanyl]phosphanyl]phosphanyl]phosphane;bis[bis[bis(phosphanyl)phosphanyl]phosphanyl]-[bis[bis(phosphanyl)phosphanyl]phosphanyl-[bis[bis(phosphanyl)phosphanyl]phosphanyl-[bis(phosphanyl)phosphanyl-phosphanylphosphanyl]phosphanyl]phosphanyl]phosphane;(1S,2E,4S,5S,9R,12R,14S)-9-[tert-butyl(dimethyl)silyl]oxy-5-[(2E,4E,6S)-7-[(2R,3R)-3-[(2S,3S)-3-[diethyl(propan-2-yl)silyl]oxypentan-2-yl]oxiran-2-yl]-6-methylhepta-2,4-dien-2-yl]-4,12-dimethyl-14-phenyl-6,13,15-trioxabicyclo[10.3.0]pentadec-2-en-7-one;(1S,2E,4S,5S,9R,12R,14S)-9-hydroxy-5-[(2E,4E,6S)-7-[(2R,3R)-3-[(2R,3S)-3-hydroxypentan-2-yl]oxiran-2-yl]-6-methylhepta-2,4-dien-2-yl]-4,12-dimethyl-14-phenyl-6,13,15-trioxabicyclo[10.3.0]pentadec-2-en-7-one with MolForge

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Frequently Asked Questions

What is the IUPAC name of bis[bis[bis(phosphanyl)phosphanyl]phosphanyl]-[bis[bis(phosphanyl)phosphanyl]phosphanyl-[bis[bis(phosphanyl)phosphanyl]phosphanyl-[bis(phosphanyl)phosphanyl-(diphosphanyl)phosphanyl]phosphanyl]phosphanyl]phosphane;bis[bis[bis(phosphanyl)phosphanyl]phosphanyl]-[bis[bis(phosphanyl)phosphanyl]phosphanyl-[bis[bis(phosphanyl)phosphanyl]phosphanyl-[bis(phosphanyl)phosphanyl-phosphanylphosphanyl]phosphanyl]phosphanyl]phosphane;(1S,2E,4S,5S,9R,12R,14S)-9-[tert-butyl(dimethyl)silyl]oxy-5-[(2E,4E,6S)-7-[(2R,3R)-3-[(2S,3S)-3-[diethyl(propan-2-yl)silyl]oxypentan-2-yl]oxiran-2-yl]-6-methylhepta-2,4-dien-2-yl]-4,12-dimethyl-14-phenyl-6,13,15-trioxabicyclo[10.3.0]pentadec-2-en-7-one;(1S,2E,4S,5S,9R,12R,14S)-9-hydroxy-5-[(2E,4E,6S)-7-[(2R,3R)-3-[(2R,3S)-3-hydroxypentan-2-yl]oxiran-2-yl]-6-methylhepta-2,4-dien-2-yl]-4,12-dimethyl-14-phenyl-6,13,15-trioxabicyclo[10.3.0]pentadec-2-en-7-one?
The IUPAC name of bis[bis[bis(phosphanyl)phosphanyl]phosphanyl]-[bis[bis(phosphanyl)phosphanyl]phosphanyl-[bis[bis(phosphanyl)phosphanyl]phosphanyl-[bis(phosphanyl)phosphanyl-(diphosphanyl)phosphanyl]phosphanyl]phosphanyl]phosphane;bis[bis[bis(phosphanyl)phosphanyl]phosphanyl]-[bis[bis(phosphanyl)phosphanyl]phosphanyl-[bis[bis(phosphanyl)phosphanyl]phosphanyl-[bis(phosphanyl)phosphanyl-phosphanylphosphanyl]phosphanyl]phosphanyl]phosphane;(1S,2E,4S,5S,9R,12R,14S)-9-[tert-butyl(dimethyl)silyl]oxy-5-[(2E,4E,6S)-7-[(2R,3R)-3-[(2S,3S)-3-[diethyl(propan-2-yl)silyl]oxypentan-2-yl]oxiran-2-yl]-6-methylhepta-2,4-dien-2-yl]-4,12-dimethyl-14-phenyl-6,13,15-trioxabicyclo[10.3.0]pentadec-2-en-7-one;(1S,2E,4S,5S,9R,12R,14S)-9-hydroxy-5-[(2E,4E,6S)-7-[(2R,3R)-3-[(2R,3S)-3-hydroxypentan-2-yl]oxiran-2-yl]-6-methylhepta-2,4-dien-2-yl]-4,12-dimethyl-14-phenyl-6,13,15-trioxabicyclo[10.3.0]pentadec-2-en-7-one (CID 158459067) is bis[bis[bis(phosphanyl)phosphanyl]phosphanyl]-[bis[bis(phosphanyl)phosphanyl]phosphanyl-[bis[bis(phosphanyl)phosphanyl]phosphanyl-[bis(phosphanyl)phosphanyl-(diphosphanyl)phosphanyl]phosphanyl]phosphanyl]phosphane;bis[bis[bis(phosphanyl)phosphanyl]phosphanyl]-[bis[bis(phosphanyl)phosphanyl]phosphanyl-[bis[bis(phosphanyl)phosphanyl]phosphanyl-[bis(phosphanyl)phosphanyl-phosphanylphosphanyl]phosphanyl]phosphanyl]phosphane;(1S,2E,4S,5S,9R,12R,14S)-9-[tert-butyl(dimethyl)silyl]oxy-5-[(2E,4E,6S)-7-[(2R,3R)-3-[(2S,3S)-3-[diethyl(propan-2-yl)silyl]oxypentan-2-yl]oxiran-2-yl]-6-methylhepta-2,4-dien-2-yl]-4,12-dimethyl-14-phenyl-6,13,15-trioxabicyclo[10.3.0]pentadec-2-en-7-one;(1S,2E,4S,5S,9R,12R,14S)-9-hydroxy-5-[(2E,4E,6S)-7-[(2R,3R)-3-[(2R,3S)-3-hydroxypentan-2-yl]oxiran-2-yl]-6-methylhepta-2,4-dien-2-yl]-4,12-dimethyl-14-phenyl-6,13,15-trioxabicyclo[10.3.0]pentadec-2-en-7-one.
What is the SMILES notation for bis[bis[bis(phosphanyl)phosphanyl]phosphanyl]-[bis[bis(phosphanyl)phosphanyl]phosphanyl-[bis[bis(phosphanyl)phosphanyl]phosphanyl-[bis(phosphanyl)phosphanyl-(diphosphanyl)phosphanyl]phosphanyl]phosphanyl]phosphane;bis[bis[bis(phosphanyl)phosphanyl]phosphanyl]-[bis[bis(phosphanyl)phosphanyl]phosphanyl-[bis[bis(phosphanyl)phosphanyl]phosphanyl-[bis(phosphanyl)phosphanyl-phosphanylphosphanyl]phosphanyl]phosphanyl]phosphane;(1S,2E,4S,5S,9R,12R,14S)-9-[tert-butyl(dimethyl)silyl]oxy-5-[(2E,4E,6S)-7-[(2R,3R)-3-[(2S,3S)-3-[diethyl(propan-2-yl)silyl]oxypentan-2-yl]oxiran-2-yl]-6-methylhepta-2,4-dien-2-yl]-4,12-dimethyl-14-phenyl-6,13,15-trioxabicyclo[10.3.0]pentadec-2-en-7-one;(1S,2E,4S,5S,9R,12R,14S)-9-hydroxy-5-[(2E,4E,6S)-7-[(2R,3R)-3-[(2R,3S)-3-hydroxypentan-2-yl]oxiran-2-yl]-6-methylhepta-2,4-dien-2-yl]-4,12-dimethyl-14-phenyl-6,13,15-trioxabicyclo[10.3.0]pentadec-2-en-7-one?
The canonical SMILES for bis[bis[bis(phosphanyl)phosphanyl]phosphanyl]-[bis[bis(phosphanyl)phosphanyl]phosphanyl-[bis[bis(phosphanyl)phosphanyl]phosphanyl-[bis(phosphanyl)phosphanyl-(diphosphanyl)phosphanyl]phosphanyl]phosphanyl]phosphane;bis[bis[bis(phosphanyl)phosphanyl]phosphanyl]-[bis[bis(phosphanyl)phosphanyl]phosphanyl-[bis[bis(phosphanyl)phosphanyl]phosphanyl-[bis(phosphanyl)phosphanyl-phosphanylphosphanyl]phosphanyl]phosphanyl]phosphane;(1S,2E,4S,5S,9R,12R,14S)-9-[tert-butyl(dimethyl)silyl]oxy-5-[(2E,4E,6S)-7-[(2R,3R)-3-[(2S,3S)-3-[diethyl(propan-2-yl)silyl]oxypentan-2-yl]oxiran-2-yl]-6-methylhepta-2,4-dien-2-yl]-4,12-dimethyl-14-phenyl-6,13,15-trioxabicyclo[10.3.0]pentadec-2-en-7-one;(1S,2E,4S,5S,9R,12R,14S)-9-hydroxy-5-[(2E,4E,6S)-7-[(2R,3R)-3-[(2R,3S)-3-hydroxypentan-2-yl]oxiran-2-yl]-6-methylhepta-2,4-dien-2-yl]-4,12-dimethyl-14-phenyl-6,13,15-trioxabicyclo[10.3.0]pentadec-2-en-7-one is CC[C@H](O)[C@@H](C)[C@H]1O[C@@H]1C[C@H](C)/C=C/C=C(\C)[C@H]1OC(=O)C[C@H](O)CC[C@@]2(C)O[C@@H](c3ccccc3)O[C@H]2/C=C/[C@@H]1C.CC[C@H](O[Si](CC)(CC)C(C)C)[C@@H](C)[C@H]1O[C@@H]1C[C@H](C)/C=C/C=C(\C)[C@H]1OC(=O)C[C@H](O[Si](C)(C)C(C)(C)C)CC[C@@]2(C)O[C@@H](c3ccccc3)O[C@H]2/C=C/[C@@H]1C.PP(P)P(P)P(P(P(P)P)P(P)P)P(P(P(P)P)P(P)P)P(P(P(P)P)P(P)P)P(P(P)P)P(P)P.PPP(P(P)P)P(P(P(P)P)P(P)P)P(P(P(P)P)P(P)P)P(P(P(P)P)P(P)P)P(P(P)P)P(P)P.
What is the InChIKey of bis[bis[bis(phosphanyl)phosphanyl]phosphanyl]-[bis[bis(phosphanyl)phosphanyl]phosphanyl-[bis[bis(phosphanyl)phosphanyl]phosphanyl-[bis(phosphanyl)phosphanyl-(diphosphanyl)phosphanyl]phosphanyl]phosphanyl]phosphane;bis[bis[bis(phosphanyl)phosphanyl]phosphanyl]-[bis[bis(phosphanyl)phosphanyl]phosphanyl-[bis[bis(phosphanyl)phosphanyl]phosphanyl-[bis(phosphanyl)phosphanyl-phosphanylphosphanyl]phosphanyl]phosphanyl]phosphane;(1S,2E,4S,5S,9R,12R,14S)-9-[tert-butyl(dimethyl)silyl]oxy-5-[(2E,4E,6S)-7-[(2R,3R)-3-[(2S,3S)-3-[diethyl(propan-2-yl)silyl]oxypentan-2-yl]oxiran-2-yl]-6-methylhepta-2,4-dien-2-yl]-4,12-dimethyl-14-phenyl-6,13,15-trioxabicyclo[10.3.0]pentadec-2-en-7-one;(1S,2E,4S,5S,9R,12R,14S)-9-hydroxy-5-[(2E,4E,6S)-7-[(2R,3R)-3-[(2R,3S)-3-hydroxypentan-2-yl]oxiran-2-yl]-6-methylhepta-2,4-dien-2-yl]-4,12-dimethyl-14-phenyl-6,13,15-trioxabicyclo[10.3.0]pentadec-2-en-7-one?
The InChIKey is HEYAZBOURBMGCZ-YYIZVPMYSA-N. The full InChI is InChI=1S/C48H80O7Si2.C35H50O7.H39P37.H38P36/c1-16-40(55-57(17-2,18-3)33(4)5)37(9)45-41(50-45)31-34(6)23-22-24-35(7)44-36(8)27-28-42-48(13,53-46(51-42)38-25-20-19-21-26-38)30-29-39(32-43(49)52-44)54-56(14,15)47(10,11)12;1-7-28(37)25(5)33-29(39-33)20-22(2)12-11-13-23(3)32-24(4)16-17-30-35(6,19-18-27(36)21-31(38)41-32)42-34(40-30)26-14-9-8-10-15-26;1-20-30(21(2)3)35(31(22(4)5)23(6)7)37(34(28(16)17)29(18)19)36(32(24(8)9)25(10)11)33(26(12)13)27(14)15;1-20(2)29(19)34(30(21(3)4)22(5)6)36(33(27(15)16)28(17)18)35(31(23(7)8)24(9)10)32(25(11)12)26(13)14/h19-28,33-34,36-37,39-42,44-46H,16-18,29-32H2,1-15H3;8-17,22,24-25,27-30,32-34,36-37H,7,18-21H2,1-6H3;20H,1-19H2;1-19H2/b23-22+,28-27+,35-24+;12-11+,17-16+,23-13+;;/t34-,36+,37-,39-,40+,41-,42+,44-,45-,46+,48-;22-,24+,25-,27-,28+,29-,30+,32-,33-,34+,35-;;/m11../s1.
What are the key properties of bis[bis[bis(phosphanyl)phosphanyl]phosphanyl]-[bis[bis(phosphanyl)phosphanyl]phosphanyl-[bis[bis(phosphanyl)phosphanyl]phosphanyl-[bis(phosphanyl)phosphanyl-(diphosphanyl)phosphanyl]phosphanyl]phosphanyl]phosphane;bis[bis[bis(phosphanyl)phosphanyl]phosphanyl]-[bis[bis(phosphanyl)phosphanyl]phosphanyl-[bis[bis(phosphanyl)phosphanyl]phosphanyl-[bis(phosphanyl)phosphanyl-phosphanylphosphanyl]phosphanyl]phosphanyl]phosphane;(1S,2E,4S,5S,9R,12R,14S)-9-[tert-butyl(dimethyl)silyl]oxy-5-[(2E,4E,6S)-7-[(2R,3R)-3-[(2S,3S)-3-[diethyl(propan-2-yl)silyl]oxypentan-2-yl]oxiran-2-yl]-6-methylhepta-2,4-dien-2-yl]-4,12-dimethyl-14-phenyl-6,13,15-trioxabicyclo[10.3.0]pentadec-2-en-7-one;(1S,2E,4S,5S,9R,12R,14S)-9-hydroxy-5-[(2E,4E,6S)-7-[(2R,3R)-3-[(2R,3S)-3-hydroxypentan-2-yl]oxiran-2-yl]-6-methylhepta-2,4-dien-2-yl]-4,12-dimethyl-14-phenyl-6,13,15-trioxabicyclo[10.3.0]pentadec-2-en-7-one?
bis[bis[bis(phosphanyl)phosphanyl]phosphanyl]-[bis[bis(phosphanyl)phosphanyl]phosphanyl-[bis[bis(phosphanyl)phosphanyl]phosphanyl-[bis(phosphanyl)phosphanyl-(diphosphanyl)phosphanyl]phosphanyl]phosphanyl]phosphane;bis[bis[bis(phosphanyl)phosphanyl]phosphanyl]-[bis[bis(phosphanyl)phosphanyl]phosphanyl-[bis[bis(phosphanyl)phosphanyl]phosphanyl-[bis(phosphanyl)phosphanyl-phosphanylphosphanyl]phosphanyl]phosphanyl]phosphane;(1S,2E,4S,5S,9R,12R,14S)-9-[tert-butyl(dimethyl)silyl]oxy-5-[(2E,4E,6S)-7-[(2R,3R)-3-[(2S,3S)-3-[diethyl(propan-2-yl)silyl]oxypentan-2-yl]oxiran-2-yl]-6-methylhepta-2,4-dien-2-yl]-4,12-dimethyl-14-phenyl-6,13,15-trioxabicyclo[10.3.0]pentadec-2-en-7-one;(1S,2E,4S,5S,9R,12R,14S)-9-hydroxy-5-[(2E,4E,6S)-7-[(2R,3R)-3-[(2R,3S)-3-hydroxypentan-2-yl]oxiran-2-yl]-6-methylhepta-2,4-dien-2-yl]-4,12-dimethyl-14-phenyl-6,13,15-trioxabicyclo[10.3.0]pentadec-2-en-7-one has a molecular weight of 3746.83 g/mol, XLogP of 61.13, 58 rotatable bonds, 2 hydrogen bond donors, and 14 hydrogen bond acceptors.
Where does this data come from?
All data for bis[bis[bis(phosphanyl)phosphanyl]phosphanyl]-[bis[bis(phosphanyl)phosphanyl]phosphanyl-[bis[bis(phosphanyl)phosphanyl]phosphanyl-[bis(phosphanyl)phosphanyl-(diphosphanyl)phosphanyl]phosphanyl]phosphanyl]phosphane;bis[bis[bis(phosphanyl)phosphanyl]phosphanyl]-[bis[bis(phosphanyl)phosphanyl]phosphanyl-[bis[bis(phosphanyl)phosphanyl]phosphanyl-[bis(phosphanyl)phosphanyl-phosphanylphosphanyl]phosphanyl]phosphanyl]phosphane;(1S,2E,4S,5S,9R,12R,14S)-9-[tert-butyl(dimethyl)silyl]oxy-5-[(2E,4E,6S)-7-[(2R,3R)-3-[(2S,3S)-3-[diethyl(propan-2-yl)silyl]oxypentan-2-yl]oxiran-2-yl]-6-methylhepta-2,4-dien-2-yl]-4,12-dimethyl-14-phenyl-6,13,15-trioxabicyclo[10.3.0]pentadec-2-en-7-one;(1S,2E,4S,5S,9R,12R,14S)-9-hydroxy-5-[(2E,4E,6S)-7-[(2R,3R)-3-[(2R,3S)-3-hydroxypentan-2-yl]oxiran-2-yl]-6-methylhepta-2,4-dien-2-yl]-4,12-dimethyl-14-phenyl-6,13,15-trioxabicyclo[10.3.0]pentadec-2-en-7-one is sourced from PubChem (CID 158459067), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).