[(3R,4S,5S,6R)-5-methoxy-4-[(2R,3R)-2-methyl-3-(3-methylbut-2-enyl)oxiran-2-yl]-1-oxaspiro[2.5]octan-6-yl] N-[(2R)-1-[[3-(dimethylamino)-2,2-dimethylpropyl]amino]-3-methyl-1-oxobutan-2-yl]carbamate;[(3R,4S,5S,6R)-5-methoxy-4-[(2R,3R)-2-methyl-3-(3-methylbut-2-enyl)oxiran-2-yl]-1-oxaspiro[2.5]octan-6-yl] N-[(2R)-1-[2-(dimethylamino)ethylamino]-3-methyl-1-oxobutan-2-yl]carbamate;[(3R,4S,5S,6R)-5-methoxy-4-[(2R,3R)-2-methyl-3-(3-methylbut-2-enyl)oxiran-2-yl]-1-oxaspiro[2.5]octan-6-yl] N-[(2R)-1-[2-(dimethylamino)ethyl-methylamino]-3-methyl-1-oxobutan-2-yl]carbamate;[(3R,4S,5S,6R)-5-methoxy-4-[(2R,3R)-2-methyl-3-(3-methylbut-2-enyl)oxiran-2-yl]-1-oxaspiro[2.5]octan-6-yl] N-[(2R)-1-[3-(dimethylamino)propylamino]-3-methyl-1-oxobutan-2-yl]carbamate;[(3R,4S,5S,6R)-5-methoxy-4-[(2R,3R)-2-methyl-3-(3-methylbut-2-enyl)oxiran-2-yl]-1-oxaspiro[2.5]octan-6-yl] N-[(2R)-3-methyl-1-[2-(1-methylpyrrolidin-2-yl)ethylamino]-1-oxobutan-2-yl]carbamate

C138H239N15O30 — CID 160781536

About [(3R,4S,5S,6R)-5-methoxy-4-[(2R,3R)-2-methyl-3-(3-methylbut-2-enyl)oxiran-2-yl]-1-oxaspiro[2.5]octan-6-yl] N-[(2R)-1-[[3-(dimethylamino)-2,2-dimethylpropyl]amino]-3-methyl-1-oxobutan-2-yl]carbamate;[(3R,4S,5S,6R)-5-methoxy-4-[(2R,3R)-2-methyl-3-(3-methylbut-2-enyl)oxiran-2-yl]-1-oxaspiro[2.5]octan-6-yl] N-[(2R)-1-[2-(dimethylamino)ethylamino]-3-methyl-1-oxobutan-2-yl]carbamate;[(3R,4S,5S,6R)-5-methoxy-4-[(2R,3R)-2-methyl-3-(3-methylbut-2-enyl)oxiran-2-yl]-1-oxaspiro[2.5]octan-6-yl] N-[(2R)-1-[2-(dimethylamino)ethyl-methylamino]-3-methyl-1-oxobutan-2-yl]carbamate;[(3R,4S,5S,6R)-5-methoxy-4-[(2R,3R)-2-methyl-3-(3-methylbut-2-enyl)oxiran-2-yl]-1-oxaspiro[2.5]octan-6-yl] N-[(2R)-1-[3-(dimethylamino)propylamino]-3-methyl-1-oxobutan-2-yl]carbamate;[(3R,4S,5S,6R)-5-methoxy-4-[(2R,3R)-2-methyl-3-(3-methylbut-2-enyl)oxiran-2-yl]-1-oxaspiro[2.5]octan-6-yl] N-[(2R)-3-methyl-1-[2-(1-methylpyrrolidin-2-yl)ethylamino]-1-oxobutan-2-yl]carbamate

[(3R,4S,5S,6R)-5-methoxy-4-[(2R,3R)-2-methyl-3-(3-methylbut-2-enyl)oxiran-2-yl]-1-oxaspiro[2.5]octan-6-yl] N-[(2R)-1-[[3-(dimethylamino)-2,2-dimethylpropyl]amino]-3-methyl-1-oxobutan-2-yl]carbamate;[(3R,4S,5S,6R)-5-methoxy-4-[(2R,3R)-2-methyl-3-(3-methylbut-2-enyl)oxiran-2-yl]-1-oxaspiro[2.5]octan-6-yl] N-[(2R)-1-[2-(dimethylamino)ethylamino]-3-methyl-1-oxobutan-2-yl]carbamate;[(3R,4S,5S,6R)-5-methoxy-4-[(2R,3R)-2-methyl-3-(3-methylbut-2-enyl)oxiran-2-yl]-1-oxaspiro[2.5]octan-6-yl] N-[(2R)-1-[2-(dimethylamino)ethyl-methylamino]-3-methyl-1-oxobutan-2-yl]carbamate;[(3R,4S,5S,6R)-5-methoxy-4-[(2R,3R)-2-methyl-3-(3-methylbut-2-enyl)oxiran-2-yl]-1-oxaspiro[2.5]octan-6-yl] N-[(2R)-1-[3-(dimethylamino)propylamino]-3-methyl-1-oxobutan-2-yl]carbamate;[(3R,4S,5S,6R)-5-methoxy-4-[(2R,3R)-2-methyl-3-(3-methylbut-2-enyl)oxiran-2-yl]-1-oxaspiro[2.5]octan-6-yl] N-[(2R)-3-methyl-1-[2-(1-methylpyrrolidin-2-yl)ethylamino]-1-oxobutan-2-yl]carbamate (PubChem CID 160781536) has the molecular formula C138H239N15O30 and a molecular weight of 2588.50 g/mol. Its IUPAC name is [(3R,4S,5S,6R)-5-methoxy-4-[(2R,3R)-2-methyl-3-(3-methylbut-2-enyl)oxiran-2-yl]-1-oxaspiro[2.5]octan-6-yl] N-[(2R)-1-[[3-(dimethylamino)-2,2-dimethylpropyl]amino]-3-methyl-1-oxobutan-2-yl]carbamate;[(3R,4S,5S,6R)-5-methoxy-4-[(2R,3R)-2-methyl-3-(3-methylbut-2-enyl)oxiran-2-yl]-1-oxaspiro[2.5]octan-6-yl] N-[(2R)-1-[2-(dimethylamino)ethylamino]-3-methyl-1-oxobutan-2-yl]carbamate;[(3R,4S,5S,6R)-5-methoxy-4-[(2R,3R)-2-methyl-3-(3-methylbut-2-enyl)oxiran-2-yl]-1-oxaspiro[2.5]octan-6-yl] N-[(2R)-1-[2-(dimethylamino)ethyl-methylamino]-3-methyl-1-oxobutan-2-yl]carbamate;[(3R,4S,5S,6R)-5-methoxy-4-[(2R,3R)-2-methyl-3-(3-methylbut-2-enyl)oxiran-2-yl]-1-oxaspiro[2.5]octan-6-yl] N-[(2R)-1-[3-(dimethylamino)propylamino]-3-methyl-1-oxobutan-2-yl]carbamate;[(3R,4S,5S,6R)-5-methoxy-4-[(2R,3R)-2-methyl-3-(3-methylbut-2-enyl)oxiran-2-yl]-1-oxaspiro[2.5]octan-6-yl] N-[(2R)-3-methyl-1-[2-(1-methylpyrrolidin-2-yl)ethylamino]-1-oxobutan-2-yl]carbamate.

Molecular Properties

• Compound Name: [(3R,4S,5S,6R)-5-methoxy-4-[(2R,3R)-2-methyl-3-(3-methylbut-2-enyl)oxiran-2-yl]-1-oxaspiro[2.5]octan-6-yl] N-[(2R)-1-[[3-(dimethylamino)-2,2-dimethylpropyl]amino]-3-methyl-1-oxobutan-2-yl]carbamate;[(3R,4S,5S,6R)-5-methoxy-4-[(2R,3R)-2-methyl-3-(3-methylbut-2-enyl)oxiran-2-yl]-1-oxaspiro[2.5]octan-6-yl] N-[(2R)-1-[2-(dimethylamino)ethylamino]-3-methyl-1-oxobutan-2-yl]carbamate;[(3R,4S,5S,6R)-5-methoxy-4-[(2R,3R)-2-methyl-3-(3-methylbut-2-enyl)oxiran-2-yl]-1-oxaspiro[2.5]octan-6-yl] N-[(2R)-1-[2-(dimethylamino)ethyl-methylamino]-3-methyl-1-oxobutan-2-yl]carbamate;[(3R,4S,5S,6R)-5-methoxy-4-[(2R,3R)-2-methyl-3-(3-methylbut-2-enyl)oxiran-2-yl]-1-oxaspiro[2.5]octan-6-yl] N-[(2R)-1-[3-(dimethylamino)propylamino]-3-methyl-1-oxobutan-2-yl]carbamate;[(3R,4S,5S,6R)-5-methoxy-4-[(2R,3R)-2-methyl-3-(3-methylbut-2-enyl)oxiran-2-yl]-1-oxaspiro[2.5]octan-6-yl] N-[(2R)-3-methyl-1-[2-(1-methylpyrrolidin-2-yl)ethylamino]-1-oxobutan-2-yl]carbamate
• PubChem CID: 160781536
• Molecular Formula: C138H239N15O30
• Molecular Weight: 2588.50 g/mol
• Exact Mass: 2586.76
• IUPAC Name: [(3R,4S,5S,6R)-5-methoxy-4-[(2R,3R)-2-methyl-3-(3-methylbut-2-enyl)oxiran-2-yl]-1-oxaspiro[2.5]octan-6-yl] N-[(2R)-1-[[3-(dimethylamino)-2,2-dimethylpropyl]amino]-3-methyl-1-oxobutan-2-yl]carbamate;[(3R,4S,5S,6R)-5-methoxy-4-[(2R,3R)-2-methyl-3-(3-methylbut-2-enyl)oxiran-2-yl]-1-oxaspiro[2.5]octan-6-yl] N-[(2R)-1-[2-(dimethylamino)ethylamino]-3-methyl-1-oxobutan-2-yl]carbamate;[(3R,4S,5S,6R)-5-methoxy-4-[(2R,3R)-2-methyl-3-(3-methylbut-2-enyl)oxiran-2-yl]-1-oxaspiro[2.5]octan-6-yl] N-[(2R)-1-[2-(dimethylamino)ethyl-methylamino]-3-methyl-1-oxobutan-2-yl]carbamate;[(3R,4S,5S,6R)-5-methoxy-4-[(2R,3R)-2-methyl-3-(3-methylbut-2-enyl)oxiran-2-yl]-1-oxaspiro[2.5]octan-6-yl] N-[(2R)-1-[3-(dimethylamino)propylamino]-3-methyl-1-oxobutan-2-yl]carbamate;[(3R,4S,5S,6R)-5-methoxy-4-[(2R,3R)-2-methyl-3-(3-methylbut-2-enyl)oxiran-2-yl]-1-oxaspiro[2.5]octan-6-yl] N-[(2R)-3-methyl-1-[2-(1-methylpyrrolidin-2-yl)ethylamino]-1-oxobutan-2-yl]carbamate
• SMILES: CO[C@@H]1[C@H](OC(=O)N[C@@H](C(=O)N(C)CCN(C)C)C(C)C)CC[C@]2(CO2)[C@H]1[C@@]1(C)O[C@@H]1CC=C(C)C.CO[C@@H]1[C@H](OC(=O)N[C@@H](C(=O)NCC(C)(C)CN(C)C)C(C)C)CC[C@]2(CO2)[C@H]1[C@@]1(C)O[C@@H]1CC=C(C)C.CO[C@@H]1[C@H](OC(=O)N[C@@H](C(=O)NCCC2CCCN2C)C(C)C)CC[C@]2(CO2)[C@H]1[C@@]1(C)O[C@@H]1CC=C(C)C.CO[C@@H]1[C@H](OC(=O)N[C@@H](C(=O)NCCCN(C)C)C(C)C)CC[C@]2(CO2)[C@H]1[C@@]1(C)O[C@@H]1CC=C(C)C.CO[C@@H]1[C@H](OC(=O)N[C@@H](C(=O)NCCN(C)C)C(C)C)CC[C@]2(CO2)[C@H]1[C@@]1(C)O[C@@H]1CC=C(C)C
• InChI: InChI=1S/C29H49N3O6.C29H51N3O6.2C27H47N3O6.C26H45N3O6/c1-18(2)10-11-22-28(5,38-22)25-24(35-7)21(12-14-29(25)17-36-29)37-27(34)31-23(19(3)4)26(33)30-15-13-20-9-8-16-32(20)6;1-18(2)11-12-21-28(7,38-21)24-23(35-10)20(13-14-29(24)17-36-29)37-26(34)31-22(19(3)4)25(33)30-15-27(5,6)16-32(8)9;1-17(2)10-11-20-26(5,36-20)23-22(33-9)19(12-13-27(23)16-34-27)35-25(32)28-21(18(3)4)24(31)30(8)15-14-29(6)7;1-17(2)10-11-20-26(5,36-20)23-22(33-8)19(12-13-27(23)16-34-27)35-25(32)29-21(18(3)4)24(31)28-14-9-15-30(6)7;1-16(2)9-10-19-25(5,35-19)22-21(32-8)18(11-12-26(22)15-33-26)34-24(31)28-20(17(3)4)23(30)27-13-14-29(6)7/h10,19-25H,8-9,11-17H2,1-7H3,(H,30,33)(H,31,34);11,19-24H,12-17H2,1-10H3,(H,30,33)(H,31,34);10,18-23H,11-16H2,1-9H3,(H,28,32);10,18-23H,9,11-16H2,1-8H3,(H,28,31)(H,29,32);9,17-22H,10-15H2,1-8H3,(H,27,30)(H,28,31)/t20?,21-,22-,23-,24-,25-,28+,29+;20-,21-,22-,23-,24-,28+,29+;2*19-,20-,21-,22-,23-,26+,27+;18-,19-,20-,21-,22-,25+,26+/m11111/s1
• InChIKey: SAQLBJCYSFWCGY-RFEOZFSDSA-N
• XLogP: 15.14
• TPSA: 516.01 Ų
• H-Bond Donors: 9
• H-Bond Acceptors: 35
• Rotatable Bonds: 57
• Heavy Atoms: 183
• Complexity: —

Lipinski Rule of Five

4 violations

Rule	Value
MW ≤ 500	2588.50
LogP ≤ 5	15.14
H-Bond Donors ≤ 5	9
H-Bond Acceptors ≤ 10	35

Computed Properties (RDKit)

• Structural Alerts: {'alert_name': '>_2_ester_groups', 'substructure': 'N/A'}, {'alert_name': 'Aliphatic_long_chain', 'substructure': 'N/A'}, {'alert_name': 'isolated_alkene', 'substructure': 'N/A'}, {'alert_name': 'Three-membered_heterocycle', 'substructure': 'N/A'}

Frequently Asked Questions

What is the IUPAC name of [(3R,4S,5S,6R)-5-methoxy-4-[(2R,3R)-2-methyl-3-(3-methylbut-2-enyl)oxiran-2-yl]-1-oxaspiro[2.5]octan-6-yl] N-[(2R)-1-[[3-(dimethylamino)-2,2-dimethylpropyl]amino]-3-methyl-1-oxobutan-2-yl]carbamate;[(3R,4S,5S,6R)-5-methoxy-4-[(2R,3R)-2-methyl-3-(3-methylbut-2-enyl)oxiran-2-yl]-1-oxaspiro[2.5]octan-6-yl] N-[(2R)-1-[2-(dimethylamino)ethylamino]-3-methyl-1-oxobutan-2-yl]carbamate;[(3R,4S,5S,6R)-5-methoxy-4-[(2R,3R)-2-methyl-3-(3-methylbut-2-enyl)oxiran-2-yl]-1-oxaspiro[2.5]octan-6-yl] N-[(2R)-1-[2-(dimethylamino)ethyl-methylamino]-3-methyl-1-oxobutan-2-yl]carbamate;[(3R,4S,5S,6R)-5-methoxy-4-[(2R,3R)-2-methyl-3-(3-methylbut-2-enyl)oxiran-2-yl]-1-oxaspiro[2.5]octan-6-yl] N-[(2R)-1-[3-(dimethylamino)propylamino]-3-methyl-1-oxobutan-2-yl]carbamate;[(3R,4S,5S,6R)-5-methoxy-4-[(2R,3R)-2-methyl-3-(3-methylbut-2-enyl)oxiran-2-yl]-1-oxaspiro[2.5]octan-6-yl] N-[(2R)-3-methyl-1-[2-(1-methylpyrrolidin-2-yl)ethylamino]-1-oxobutan-2-yl]carbamate?

The IUPAC name of [(3R,4S,5S,6R)-5-methoxy-4-[(2R,3R)-2-methyl-3-(3-methylbut-2-enyl)oxiran-2-yl]-1-oxaspiro[2.5]octan-6-yl] N-[(2R)-1-[[3-(dimethylamino)-2,2-dimethylpropyl]amino]-3-methyl-1-oxobutan-2-yl]carbamate;[(3R,4S,5S,6R)-5-methoxy-4-[(2R,3R)-2-methyl-3-(3-methylbut-2-enyl)oxiran-2-yl]-1-oxaspiro[2.5]octan-6-yl] N-[(2R)-1-[2-(dimethylamino)ethylamino]-3-methyl-1-oxobutan-2-yl]carbamate;[(3R,4S,5S,6R)-5-methoxy-4-[(2R,3R)-2-methyl-3-(3-methylbut-2-enyl)oxiran-2-yl]-1-oxaspiro[2.5]octan-6-yl] N-[(2R)-1-[2-(dimethylamino)ethyl-methylamino]-3-methyl-1-oxobutan-2-yl]carbamate;[(3R,4S,5S,6R)-5-methoxy-4-[(2R,3R)-2-methyl-3-(3-methylbut-2-enyl)oxiran-2-yl]-1-oxaspiro[2.5]octan-6-yl] N-[(2R)-1-[3-(dimethylamino)propylamino]-3-methyl-1-oxobutan-2-yl]carbamate;[(3R,4S,5S,6R)-5-methoxy-4-[(2R,3R)-2-methyl-3-(3-methylbut-2-enyl)oxiran-2-yl]-1-oxaspiro[2.5]octan-6-yl] N-[(2R)-3-methyl-1-[2-(1-methylpyrrolidin-2-yl)ethylamino]-1-oxobutan-2-yl]carbamate (CID 160781536) is [(3R,4S,5S,6R)-5-methoxy-4-[(2R,3R)-2-methyl-3-(3-methylbut-2-enyl)oxiran-2-yl]-1-oxaspiro[2.5]octan-6-yl] N-[(2R)-1-[[3-(dimethylamino)-2,2-dimethylpropyl]amino]-3-methyl-1-oxobutan-2-yl]carbamate;[(3R,4S,5S,6R)-5-methoxy-4-[(2R,3R)-2-methyl-3-(3-methylbut-2-enyl)oxiran-2-yl]-1-oxaspiro[2.5]octan-6-yl] N-[(2R)-1-[2-(dimethylamino)ethylamino]-3-methyl-1-oxobutan-2-yl]carbamate;[(3R,4S,5S,6R)-5-methoxy-4-[(2R,3R)-2-methyl-3-(3-methylbut-2-enyl)oxiran-2-yl]-1-oxaspiro[2.5]octan-6-yl] N-[(2R)-1-[2-(dimethylamino)ethyl-methylamino]-3-methyl-1-oxobutan-2-yl]carbamate;[(3R,4S,5S,6R)-5-methoxy-4-[(2R,3R)-2-methyl-3-(3-methylbut-2-enyl)oxiran-2-yl]-1-oxaspiro[2.5]octan-6-yl] N-[(2R)-1-[3-(dimethylamino)propylamino]-3-methyl-1-oxobutan-2-yl]carbamate;[(3R,4S,5S,6R)-5-methoxy-4-[(2R,3R)-2-methyl-3-(3-methylbut-2-enyl)oxiran-2-yl]-1-oxaspiro[2.5]octan-6-yl] N-[(2R)-3-methyl-1-[2-(1-methylpyrrolidin-2-yl)ethylamino]-1-oxobutan-2-yl]carbamate.

What is the SMILES notation for [(3R,4S,5S,6R)-5-methoxy-4-[(2R,3R)-2-methyl-3-(3-methylbut-2-enyl)oxiran-2-yl]-1-oxaspiro[2.5]octan-6-yl] N-[(2R)-1-[[3-(dimethylamino)-2,2-dimethylpropyl]amino]-3-methyl-1-oxobutan-2-yl]carbamate;[(3R,4S,5S,6R)-5-methoxy-4-[(2R,3R)-2-methyl-3-(3-methylbut-2-enyl)oxiran-2-yl]-1-oxaspiro[2.5]octan-6-yl] N-[(2R)-1-[2-(dimethylamino)ethylamino]-3-methyl-1-oxobutan-2-yl]carbamate;[(3R,4S,5S,6R)-5-methoxy-4-[(2R,3R)-2-methyl-3-(3-methylbut-2-enyl)oxiran-2-yl]-1-oxaspiro[2.5]octan-6-yl] N-[(2R)-1-[2-(dimethylamino)ethyl-methylamino]-3-methyl-1-oxobutan-2-yl]carbamate;[(3R,4S,5S,6R)-5-methoxy-4-[(2R,3R)-2-methyl-3-(3-methylbut-2-enyl)oxiran-2-yl]-1-oxaspiro[2.5]octan-6-yl] N-[(2R)-1-[3-(dimethylamino)propylamino]-3-methyl-1-oxobutan-2-yl]carbamate;[(3R,4S,5S,6R)-5-methoxy-4-[(2R,3R)-2-methyl-3-(3-methylbut-2-enyl)oxiran-2-yl]-1-oxaspiro[2.5]octan-6-yl] N-[(2R)-3-methyl-1-[2-(1-methylpyrrolidin-2-yl)ethylamino]-1-oxobutan-2-yl]carbamate?

The canonical SMILES for [(3R,4S,5S,6R)-5-methoxy-4-[(2R,3R)-2-methyl-3-(3-methylbut-2-enyl)oxiran-2-yl]-1-oxaspiro[2.5]octan-6-yl] N-[(2R)-1-[[3-(dimethylamino)-2,2-dimethylpropyl]amino]-3-methyl-1-oxobutan-2-yl]carbamate;[(3R,4S,5S,6R)-5-methoxy-4-[(2R,3R)-2-methyl-3-(3-methylbut-2-enyl)oxiran-2-yl]-1-oxaspiro[2.5]octan-6-yl] N-[(2R)-1-[2-(dimethylamino)ethylamino]-3-methyl-1-oxobutan-2-yl]carbamate;[(3R,4S,5S,6R)-5-methoxy-4-[(2R,3R)-2-methyl-3-(3-methylbut-2-enyl)oxiran-2-yl]-1-oxaspiro[2.5]octan-6-yl] N-[(2R)-1-[2-(dimethylamino)ethyl-methylamino]-3-methyl-1-oxobutan-2-yl]carbamate;[(3R,4S,5S,6R)-5-methoxy-4-[(2R,3R)-2-methyl-3-(3-methylbut-2-enyl)oxiran-2-yl]-1-oxaspiro[2.5]octan-6-yl] N-[(2R)-1-[3-(dimethylamino)propylamino]-3-methyl-1-oxobutan-2-yl]carbamate;[(3R,4S,5S,6R)-5-methoxy-4-[(2R,3R)-2-methyl-3-(3-methylbut-2-enyl)oxiran-2-yl]-1-oxaspiro[2.5]octan-6-yl] N-[(2R)-3-methyl-1-[2-(1-methylpyrrolidin-2-yl)ethylamino]-1-oxobutan-2-yl]carbamate is CO[C@@H]1[C@H](OC(=O)N[C@@H](C(=O)N(C)CCN(C)C)C(C)C)CC[C@]2(CO2)[C@H]1[C@@]1(C)O[C@@H]1CC=C(C)C.CO[C@@H]1[C@H](OC(=O)N[C@@H](C(=O)NCC(C)(C)CN(C)C)C(C)C)CC[C@]2(CO2)[C@H]1[C@@]1(C)O[C@@H]1CC=C(C)C.CO[C@@H]1[C@H](OC(=O)N[C@@H](C(=O)NCCC2CCCN2C)C(C)C)CC[C@]2(CO2)[C@H]1[C@@]1(C)O[C@@H]1CC=C(C)C.CO[C@@H]1[C@H](OC(=O)N[C@@H](C(=O)NCCCN(C)C)C(C)C)CC[C@]2(CO2)[C@H]1[C@@]1(C)O[C@@H]1CC=C(C)C.CO[C@@H]1[C@H](OC(=O)N[C@@H](C(=O)NCCN(C)C)C(C)C)CC[C@]2(CO2)[C@H]1[C@@]1(C)O[C@@H]1CC=C(C)C.

What is the InChIKey of [(3R,4S,5S,6R)-5-methoxy-4-[(2R,3R)-2-methyl-3-(3-methylbut-2-enyl)oxiran-2-yl]-1-oxaspiro[2.5]octan-6-yl] N-[(2R)-1-[[3-(dimethylamino)-2,2-dimethylpropyl]amino]-3-methyl-1-oxobutan-2-yl]carbamate;[(3R,4S,5S,6R)-5-methoxy-4-[(2R,3R)-2-methyl-3-(3-methylbut-2-enyl)oxiran-2-yl]-1-oxaspiro[2.5]octan-6-yl] N-[(2R)-1-[2-(dimethylamino)ethylamino]-3-methyl-1-oxobutan-2-yl]carbamate;[(3R,4S,5S,6R)-5-methoxy-4-[(2R,3R)-2-methyl-3-(3-methylbut-2-enyl)oxiran-2-yl]-1-oxaspiro[2.5]octan-6-yl] N-[(2R)-1-[2-(dimethylamino)ethyl-methylamino]-3-methyl-1-oxobutan-2-yl]carbamate;[(3R,4S,5S,6R)-5-methoxy-4-[(2R,3R)-2-methyl-3-(3-methylbut-2-enyl)oxiran-2-yl]-1-oxaspiro[2.5]octan-6-yl] N-[(2R)-1-[3-(dimethylamino)propylamino]-3-methyl-1-oxobutan-2-yl]carbamate;[(3R,4S,5S,6R)-5-methoxy-4-[(2R,3R)-2-methyl-3-(3-methylbut-2-enyl)oxiran-2-yl]-1-oxaspiro[2.5]octan-6-yl] N-[(2R)-3-methyl-1-[2-(1-methylpyrrolidin-2-yl)ethylamino]-1-oxobutan-2-yl]carbamate?

The InChIKey is SAQLBJCYSFWCGY-RFEOZFSDSA-N. The full InChI is InChI=1S/C29H49N3O6.C29H51N3O6.2C27H47N3O6.C26H45N3O6/c1-18(2)10-11-22-28(5,38-22)25-24(35-7)21(12-14-29(25)17-36-29)37-27(34)31-23(19(3)4)26(33)30-15-13-20-9-8-16-32(20)6;1-18(2)11-12-21-28(7,38-21)24-23(35-10)20(13-14-29(24)17-36-29)37-26(34)31-22(19(3)4)25(33)30-15-27(5,6)16-32(8)9;1-17(2)10-11-20-26(5,36-20)23-22(33-9)19(12-13-27(23)16-34-27)35-25(32)28-21(18(3)4)24(31)30(8)15-14-29(6)7;1-17(2)10-11-20-26(5,36-20)23-22(33-8)19(12-13-27(23)16-34-27)35-25(32)29-21(18(3)4)24(31)28-14-9-15-30(6)7;1-16(2)9-10-19-25(5,35-19)22-21(32-8)18(11-12-26(22)15-33-26)34-24(31)28-20(17(3)4)23(30)27-13-14-29(6)7/h10,19-25H,8-9,11-17H2,1-7H3,(H,30,33)(H,31,34);11,19-24H,12-17H2,1-10H3,(H,30,33)(H,31,34);10,18-23H,11-16H2,1-9H3,(H,28,32);10,18-23H,9,11-16H2,1-8H3,(H,28,31)(H,29,32);9,17-22H,10-15H2,1-8H3,(H,27,30)(H,28,31)/t20?,21-,22-,23-,24-,25-,28+,29+;20-,21-,22-,23-,24-,28+,29+;2*19-,20-,21-,22-,23-,26+,27+;18-,19-,20-,21-,22-,25+,26+/m11111/s1.

What are the key properties of [(3R,4S,5S,6R)-5-methoxy-4-[(2R,3R)-2-methyl-3-(3-methylbut-2-enyl)oxiran-2-yl]-1-oxaspiro[2.5]octan-6-yl] N-[(2R)-1-[[3-(dimethylamino)-2,2-dimethylpropyl]amino]-3-methyl-1-oxobutan-2-yl]carbamate;[(3R,4S,5S,6R)-5-methoxy-4-[(2R,3R)-2-methyl-3-(3-methylbut-2-enyl)oxiran-2-yl]-1-oxaspiro[2.5]octan-6-yl] N-[(2R)-1-[2-(dimethylamino)ethylamino]-3-methyl-1-oxobutan-2-yl]carbamate;[(3R,4S,5S,6R)-5-methoxy-4-[(2R,3R)-2-methyl-3-(3-methylbut-2-enyl)oxiran-2-yl]-1-oxaspiro[2.5]octan-6-yl] N-[(2R)-1-[2-(dimethylamino)ethyl-methylamino]-3-methyl-1-oxobutan-2-yl]carbamate;[(3R,4S,5S,6R)-5-methoxy-4-[(2R,3R)-2-methyl-3-(3-methylbut-2-enyl)oxiran-2-yl]-1-oxaspiro[2.5]octan-6-yl] N-[(2R)-1-[3-(dimethylamino)propylamino]-3-methyl-1-oxobutan-2-yl]carbamate;[(3R,4S,5S,6R)-5-methoxy-4-[(2R,3R)-2-methyl-3-(3-methylbut-2-enyl)oxiran-2-yl]-1-oxaspiro[2.5]octan-6-yl] N-[(2R)-3-methyl-1-[2-(1-methylpyrrolidin-2-yl)ethylamino]-1-oxobutan-2-yl]carbamate?

[(3R,4S,5S,6R)-5-methoxy-4-[(2R,3R)-2-methyl-3-(3-methylbut-2-enyl)oxiran-2-yl]-1-oxaspiro[2.5]octan-6-yl] N-[(2R)-1-[[3-(dimethylamino)-2,2-dimethylpropyl]amino]-3-methyl-1-oxobutan-2-yl]carbamate;[(3R,4S,5S,6R)-5-methoxy-4-[(2R,3R)-2-methyl-3-(3-methylbut-2-enyl)oxiran-2-yl]-1-oxaspiro[2.5]octan-6-yl] N-[(2R)-1-[2-(dimethylamino)ethylamino]-3-methyl-1-oxobutan-2-yl]carbamate;[(3R,4S,5S,6R)-5-methoxy-4-[(2R,3R)-2-methyl-3-(3-methylbut-2-enyl)oxiran-2-yl]-1-oxaspiro[2.5]octan-6-yl] N-[(2R)-1-[2-(dimethylamino)ethyl-methylamino]-3-methyl-1-oxobutan-2-yl]carbamate;[(3R,4S,5S,6R)-5-methoxy-4-[(2R,3R)-2-methyl-3-(3-methylbut-2-enyl)oxiran-2-yl]-1-oxaspiro[2.5]octan-6-yl] N-[(2R)-1-[3-(dimethylamino)propylamino]-3-methyl-1-oxobutan-2-yl]carbamate;[(3R,4S,5S,6R)-5-methoxy-4-[(2R,3R)-2-methyl-3-(3-methylbut-2-enyl)oxiran-2-yl]-1-oxaspiro[2.5]octan-6-yl] N-[(2R)-3-methyl-1-[2-(1-methylpyrrolidin-2-yl)ethylamino]-1-oxobutan-2-yl]carbamate has a molecular weight of 2588.50 g/mol, XLogP of 15.14, 57 rotatable bonds, 9 hydrogen bond donors, and 35 hydrogen bond acceptors.

Where does this data come from?

All data for [(3R,4S,5S,6R)-5-methoxy-4-[(2R,3R)-2-methyl-3-(3-methylbut-2-enyl)oxiran-2-yl]-1-oxaspiro[2.5]octan-6-yl] N-[(2R)-1-[[3-(dimethylamino)-2,2-dimethylpropyl]amino]-3-methyl-1-oxobutan-2-yl]carbamate;[(3R,4S,5S,6R)-5-methoxy-4-[(2R,3R)-2-methyl-3-(3-methylbut-2-enyl)oxiran-2-yl]-1-oxaspiro[2.5]octan-6-yl] N-[(2R)-1-[2-(dimethylamino)ethylamino]-3-methyl-1-oxobutan-2-yl]carbamate;[(3R,4S,5S,6R)-5-methoxy-4-[(2R,3R)-2-methyl-3-(3-methylbut-2-enyl)oxiran-2-yl]-1-oxaspiro[2.5]octan-6-yl] N-[(2R)-1-[2-(dimethylamino)ethyl-methylamino]-3-methyl-1-oxobutan-2-yl]carbamate;[(3R,4S,5S,6R)-5-methoxy-4-[(2R,3R)-2-methyl-3-(3-methylbut-2-enyl)oxiran-2-yl]-1-oxaspiro[2.5]octan-6-yl] N-[(2R)-1-[3-(dimethylamino)propylamino]-3-methyl-1-oxobutan-2-yl]carbamate;[(3R,4S,5S,6R)-5-methoxy-4-[(2R,3R)-2-methyl-3-(3-methylbut-2-enyl)oxiran-2-yl]-1-oxaspiro[2.5]octan-6-yl] N-[(2R)-3-methyl-1-[2-(1-methylpyrrolidin-2-yl)ethylamino]-1-oxobutan-2-yl]carbamate is sourced from PubChem (CID 160781536), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).