methyl (4aS,6aR,6bS,8aR,9R,12aR,14aR,14bS)-9-(acetyloxymethyl)-11-isocyano-2,2,6a,6b,9,12a-hexamethyl-10,14-dioxo-1,3,4,5,6,7,8,8a,14a,14b-decahydropicene-4a-carboxylate;methyl (4aS,6aR,6bS,8aR,9R,12aR,14aR,14bS)-9-(benzoyloxymethyl)-11-isocyano-2,2,6a,6b,9,12a-hexamethyl-10,14-dioxo-1,3,4,5,6,7,8,8a,14a,14b-decahydropicene-4a-carboxylate;methyl (4aS,6aR,6bS,8aR,9S,12aR,14aR,14bS)-9-[2-[tert-butyl(dimethyl)silyl]oxyethyl]-11-isocyano-2,2,6a,6b,9,12a-hexamethyl-10,14-dioxo-1,3,4,5,6,7,8,8a,14a,14b-decahydropicene-4a-carboxylate;methyl (4aS,6aR,6bS,8aR,9S,12aR,14aR,14bS)-11-isocyano-9-(2-methoxyethyl)-2,2,6a,6b,9,12a-hexamethyl-10,14-dioxo-1,3,4,5,6,7,8,8a,14a,14b-decahydropicene-4a-carboxylate

C146H198N4O22Si — CID 157177827

About methyl (4aS,6aR,6bS,8aR,9R,12aR,14aR,14bS)-9-(acetyloxymethyl)-11-isocyano-2,2,6a,6b,9,12a-hexamethyl-10,14-dioxo-1,3,4,5,6,7,8,8a,14a,14b-decahydropicene-4a-carboxylate;methyl (4aS,6aR,6bS,8aR,9R,12aR,14aR,14bS)-9-(benzoyloxymethyl)-11-isocyano-2,2,6a,6b,9,12a-hexamethyl-10,14-dioxo-1,3,4,5,6,7,8,8a,14a,14b-decahydropicene-4a-carboxylate;methyl (4aS,6aR,6bS,8aR,9S,12aR,14aR,14bS)-9-[2-[tert-butyl(dimethyl)silyl]oxyethyl]-11-isocyano-2,2,6a,6b,9,12a-hexamethyl-10,14-dioxo-1,3,4,5,6,7,8,8a,14a,14b-decahydropicene-4a-carboxylate;methyl (4aS,6aR,6bS,8aR,9S,12aR,14aR,14bS)-11-isocyano-9-(2-methoxyethyl)-2,2,6a,6b,9,12a-hexamethyl-10,14-dioxo-1,3,4,5,6,7,8,8a,14a,14b-decahydropicene-4a-carboxylate

methyl (4aS,6aR,6bS,8aR,9R,12aR,14aR,14bS)-9-(acetyloxymethyl)-11-isocyano-2,2,6a,6b,9,12a-hexamethyl-10,14-dioxo-1,3,4,5,6,7,8,8a,14a,14b-decahydropicene-4a-carboxylate;methyl (4aS,6aR,6bS,8aR,9R,12aR,14aR,14bS)-9-(benzoyloxymethyl)-11-isocyano-2,2,6a,6b,9,12a-hexamethyl-10,14-dioxo-1,3,4,5,6,7,8,8a,14a,14b-decahydropicene-4a-carboxylate;methyl (4aS,6aR,6bS,8aR,9S,12aR,14aR,14bS)-9-[2-[tert-butyl(dimethyl)silyl]oxyethyl]-11-isocyano-2,2,6a,6b,9,12a-hexamethyl-10,14-dioxo-1,3,4,5,6,7,8,8a,14a,14b-decahydropicene-4a-carboxylate;methyl (4aS,6aR,6bS,8aR,9S,12aR,14aR,14bS)-11-isocyano-9-(2-methoxyethyl)-2,2,6a,6b,9,12a-hexamethyl-10,14-dioxo-1,3,4,5,6,7,8,8a,14a,14b-decahydropicene-4a-carboxylate (PubChem CID 157177827) has the molecular formula C146H198N4O22Si and a molecular weight of 2389.28 g/mol. Its IUPAC name is methyl (4aS,6aR,6bS,8aR,9R,12aR,14aR,14bS)-9-(acetyloxymethyl)-11-isocyano-2,2,6a,6b,9,12a-hexamethyl-10,14-dioxo-1,3,4,5,6,7,8,8a,14a,14b-decahydropicene-4a-carboxylate;methyl (4aS,6aR,6bS,8aR,9R,12aR,14aR,14bS)-9-(benzoyloxymethyl)-11-isocyano-2,2,6a,6b,9,12a-hexamethyl-10,14-dioxo-1,3,4,5,6,7,8,8a,14a,14b-decahydropicene-4a-carboxylate;methyl (4aS,6aR,6bS,8aR,9S,12aR,14aR,14bS)-9-[2-[tert-butyl(dimethyl)silyl]oxyethyl]-11-isocyano-2,2,6a,6b,9,12a-hexamethyl-10,14-dioxo-1,3,4,5,6,7,8,8a,14a,14b-decahydropicene-4a-carboxylate;methyl (4aS,6aR,6bS,8aR,9S,12aR,14aR,14bS)-11-isocyano-9-(2-methoxyethyl)-2,2,6a,6b,9,12a-hexamethyl-10,14-dioxo-1,3,4,5,6,7,8,8a,14a,14b-decahydropicene-4a-carboxylate.

Molecular Properties

• Compound Name: methyl (4aS,6aR,6bS,8aR,9R,12aR,14aR,14bS)-9-(acetyloxymethyl)-11-isocyano-2,2,6a,6b,9,12a-hexamethyl-10,14-dioxo-1,3,4,5,6,7,8,8a,14a,14b-decahydropicene-4a-carboxylate;methyl (4aS,6aR,6bS,8aR,9R,12aR,14aR,14bS)-9-(benzoyloxymethyl)-11-isocyano-2,2,6a,6b,9,12a-hexamethyl-10,14-dioxo-1,3,4,5,6,7,8,8a,14a,14b-decahydropicene-4a-carboxylate;methyl (4aS,6aR,6bS,8aR,9S,12aR,14aR,14bS)-9-[2-[tert-butyl(dimethyl)silyl]oxyethyl]-11-isocyano-2,2,6a,6b,9,12a-hexamethyl-10,14-dioxo-1,3,4,5,6,7,8,8a,14a,14b-decahydropicene-4a-carboxylate;methyl (4aS,6aR,6bS,8aR,9S,12aR,14aR,14bS)-11-isocyano-9-(2-methoxyethyl)-2,2,6a,6b,9,12a-hexamethyl-10,14-dioxo-1,3,4,5,6,7,8,8a,14a,14b-decahydropicene-4a-carboxylate
• PubChem CID: 157177827
• Molecular Formula: C146H198N4O22Si
• Molecular Weight: 2389.28 g/mol
• Exact Mass: 2387.43
• IUPAC Name: methyl (4aS,6aR,6bS,8aR,9R,12aR,14aR,14bS)-9-(acetyloxymethyl)-11-isocyano-2,2,6a,6b,9,12a-hexamethyl-10,14-dioxo-1,3,4,5,6,7,8,8a,14a,14b-decahydropicene-4a-carboxylate;methyl (4aS,6aR,6bS,8aR,9R,12aR,14aR,14bS)-9-(benzoyloxymethyl)-11-isocyano-2,2,6a,6b,9,12a-hexamethyl-10,14-dioxo-1,3,4,5,6,7,8,8a,14a,14b-decahydropicene-4a-carboxylate;methyl (4aS,6aR,6bS,8aR,9S,12aR,14aR,14bS)-9-[2-[tert-butyl(dimethyl)silyl]oxyethyl]-11-isocyano-2,2,6a,6b,9,12a-hexamethyl-10,14-dioxo-1,3,4,5,6,7,8,8a,14a,14b-decahydropicene-4a-carboxylate;methyl (4aS,6aR,6bS,8aR,9S,12aR,14aR,14bS)-11-isocyano-9-(2-methoxyethyl)-2,2,6a,6b,9,12a-hexamethyl-10,14-dioxo-1,3,4,5,6,7,8,8a,14a,14b-decahydropicene-4a-carboxylate
• SMILES: [C-]#[N+]C1=C[C@]2(C)C3=CC(=O)[C@@H]4[C@@H]5CC(C)(C)CC[C@]5(C(=O)OC)CC[C@@]4(C)[C@]3(C)CC[C@H]2[C@](C)(CCOC)C1=O.[C-]#[N+]C1=C[C@]2(C)C3=CC(=O)[C@@H]4[C@@H]5CC(C)(C)CC[C@]5(C(=O)OC)CC[C@@]4(C)[C@]3(C)CC[C@H]2[C@](C)(CCO[Si](C)(C)C(C)(C)C)C1=O.[C-]#[N+]C1=C[C@]2(C)C3=CC(=O)[C@@H]4[C@@H]5CC(C)(C)CC[C@]5(C(=O)OC)CC[C@@]4(C)[C@]3(C)CC[C@H]2[C@](C)(COC(=O)c2ccccc2)C1=O.[C-]#[N+]C1=C[C@]2(C)C3=CC(=O)[C@@H]4[C@@H]5CC(C)(C)CC[C@]5(C(=O)OC)CC[C@@]4(C)[C@]3(C)CC[C@H]2[C@](C)(COC(C)=O)C1=O
• InChI: InChI=1S/C39H47NO6.C39H59NO5Si.C34H45NO6.C34H47NO5/c1-34(2)16-18-39(33(44)45-8)19-17-38(6)30(25(39)21-34)27(41)20-29-35(3)22-26(40-7)31(42)36(4,28(35)14-15-37(29,38)5)23-46-32(43)24-12-10-9-11-13-24;1-33(2,3)46(12,13)45-21-20-35(6)28-14-15-37(8)29(36(28,7)24-26(40-10)31(35)42)22-27(41)30-25-23-34(4,5)16-18-39(25,32(43)44-11)19-17-38(30,37)9;1-20(36)41-19-31(5)24-10-11-32(6)25(30(24,4)18-22(35-8)27(31)38)16-23(37)26-21-17-29(2,3)12-14-34(21,28(39)40-9)15-13-33(26,32)7;1-29(2)12-14-34(28(38)40-9)15-13-33(6)26(21(34)19-29)23(36)18-25-31(4)20-22(35-7)27(37)30(3,16-17-39-8)24(31)10-11-32(25,33)5/h9-13,20,22,25,28,30H,14-19,21,23H2,1-6,8H3;22,24-25,28,30H,14-21,23H2,1-9,11-13H3;16,18,21,24,26H,10-15,17,19H2,1-7,9H3;18,20-21,24,26H,10-17,19H2,1-6,8-9H3/t25-,28+,30-,35-,36-,37+,38+,39-;25-,28-,30-,35-,36-,37+,38+,39-;21-,24+,26-,30-,31-,32+,33+,34-;21-,24-,26-,30-,31-,32+,33+,34-/m0000/s1
• InChIKey: AOFLOIPZTVRDPU-ZRRARFRMSA-N
• XLogP: 29.72
• TPSA: 330.26 Ų
• H-Bond Acceptors: 22
• Rotatable Bonds: 16
• Heavy Atoms: 173
• Complexity: —

Lipinski Rule of Five

3 violations

Rule	Value
MW ≤ 500	2389.28
LogP ≤ 5	29.72
H-Bond Donors ≤ 5	0
H-Bond Acceptors ≤ 10	22

Computed Properties (RDKit)

• Structural Alerts: {'alert_name': '>_2_ester_groups', 'substructure': 'N/A'}, {'alert_name': 'Carbo_cation/anion', 'substructure': 'N/A'}, {'alert_name': 'heavy_metal', 'substructure': 'N/A'}

Frequently Asked Questions

What is the IUPAC name of methyl (4aS,6aR,6bS,8aR,9R,12aR,14aR,14bS)-9-(acetyloxymethyl)-11-isocyano-2,2,6a,6b,9,12a-hexamethyl-10,14-dioxo-1,3,4,5,6,7,8,8a,14a,14b-decahydropicene-4a-carboxylate;methyl (4aS,6aR,6bS,8aR,9R,12aR,14aR,14bS)-9-(benzoyloxymethyl)-11-isocyano-2,2,6a,6b,9,12a-hexamethyl-10,14-dioxo-1,3,4,5,6,7,8,8a,14a,14b-decahydropicene-4a-carboxylate;methyl (4aS,6aR,6bS,8aR,9S,12aR,14aR,14bS)-9-[2-[tert-butyl(dimethyl)silyl]oxyethyl]-11-isocyano-2,2,6a,6b,9,12a-hexamethyl-10,14-dioxo-1,3,4,5,6,7,8,8a,14a,14b-decahydropicene-4a-carboxylate;methyl (4aS,6aR,6bS,8aR,9S,12aR,14aR,14bS)-11-isocyano-9-(2-methoxyethyl)-2,2,6a,6b,9,12a-hexamethyl-10,14-dioxo-1,3,4,5,6,7,8,8a,14a,14b-decahydropicene-4a-carboxylate?

The IUPAC name of methyl (4aS,6aR,6bS,8aR,9R,12aR,14aR,14bS)-9-(acetyloxymethyl)-11-isocyano-2,2,6a,6b,9,12a-hexamethyl-10,14-dioxo-1,3,4,5,6,7,8,8a,14a,14b-decahydropicene-4a-carboxylate;methyl (4aS,6aR,6bS,8aR,9R,12aR,14aR,14bS)-9-(benzoyloxymethyl)-11-isocyano-2,2,6a,6b,9,12a-hexamethyl-10,14-dioxo-1,3,4,5,6,7,8,8a,14a,14b-decahydropicene-4a-carboxylate;methyl (4aS,6aR,6bS,8aR,9S,12aR,14aR,14bS)-9-[2-[tert-butyl(dimethyl)silyl]oxyethyl]-11-isocyano-2,2,6a,6b,9,12a-hexamethyl-10,14-dioxo-1,3,4,5,6,7,8,8a,14a,14b-decahydropicene-4a-carboxylate;methyl (4aS,6aR,6bS,8aR,9S,12aR,14aR,14bS)-11-isocyano-9-(2-methoxyethyl)-2,2,6a,6b,9,12a-hexamethyl-10,14-dioxo-1,3,4,5,6,7,8,8a,14a,14b-decahydropicene-4a-carboxylate (CID 157177827) is methyl (4aS,6aR,6bS,8aR,9R,12aR,14aR,14bS)-9-(acetyloxymethyl)-11-isocyano-2,2,6a,6b,9,12a-hexamethyl-10,14-dioxo-1,3,4,5,6,7,8,8a,14a,14b-decahydropicene-4a-carboxylate;methyl (4aS,6aR,6bS,8aR,9R,12aR,14aR,14bS)-9-(benzoyloxymethyl)-11-isocyano-2,2,6a,6b,9,12a-hexamethyl-10,14-dioxo-1,3,4,5,6,7,8,8a,14a,14b-decahydropicene-4a-carboxylate;methyl (4aS,6aR,6bS,8aR,9S,12aR,14aR,14bS)-9-[2-[tert-butyl(dimethyl)silyl]oxyethyl]-11-isocyano-2,2,6a,6b,9,12a-hexamethyl-10,14-dioxo-1,3,4,5,6,7,8,8a,14a,14b-decahydropicene-4a-carboxylate;methyl (4aS,6aR,6bS,8aR,9S,12aR,14aR,14bS)-11-isocyano-9-(2-methoxyethyl)-2,2,6a,6b,9,12a-hexamethyl-10,14-dioxo-1,3,4,5,6,7,8,8a,14a,14b-decahydropicene-4a-carboxylate.

What is the SMILES notation for methyl (4aS,6aR,6bS,8aR,9R,12aR,14aR,14bS)-9-(acetyloxymethyl)-11-isocyano-2,2,6a,6b,9,12a-hexamethyl-10,14-dioxo-1,3,4,5,6,7,8,8a,14a,14b-decahydropicene-4a-carboxylate;methyl (4aS,6aR,6bS,8aR,9R,12aR,14aR,14bS)-9-(benzoyloxymethyl)-11-isocyano-2,2,6a,6b,9,12a-hexamethyl-10,14-dioxo-1,3,4,5,6,7,8,8a,14a,14b-decahydropicene-4a-carboxylate;methyl (4aS,6aR,6bS,8aR,9S,12aR,14aR,14bS)-9-[2-[tert-butyl(dimethyl)silyl]oxyethyl]-11-isocyano-2,2,6a,6b,9,12a-hexamethyl-10,14-dioxo-1,3,4,5,6,7,8,8a,14a,14b-decahydropicene-4a-carboxylate;methyl (4aS,6aR,6bS,8aR,9S,12aR,14aR,14bS)-11-isocyano-9-(2-methoxyethyl)-2,2,6a,6b,9,12a-hexamethyl-10,14-dioxo-1,3,4,5,6,7,8,8a,14a,14b-decahydropicene-4a-carboxylate?

The canonical SMILES for methyl (4aS,6aR,6bS,8aR,9R,12aR,14aR,14bS)-9-(acetyloxymethyl)-11-isocyano-2,2,6a,6b,9,12a-hexamethyl-10,14-dioxo-1,3,4,5,6,7,8,8a,14a,14b-decahydropicene-4a-carboxylate;methyl (4aS,6aR,6bS,8aR,9R,12aR,14aR,14bS)-9-(benzoyloxymethyl)-11-isocyano-2,2,6a,6b,9,12a-hexamethyl-10,14-dioxo-1,3,4,5,6,7,8,8a,14a,14b-decahydropicene-4a-carboxylate;methyl (4aS,6aR,6bS,8aR,9S,12aR,14aR,14bS)-9-[2-[tert-butyl(dimethyl)silyl]oxyethyl]-11-isocyano-2,2,6a,6b,9,12a-hexamethyl-10,14-dioxo-1,3,4,5,6,7,8,8a,14a,14b-decahydropicene-4a-carboxylate;methyl (4aS,6aR,6bS,8aR,9S,12aR,14aR,14bS)-11-isocyano-9-(2-methoxyethyl)-2,2,6a,6b,9,12a-hexamethyl-10,14-dioxo-1,3,4,5,6,7,8,8a,14a,14b-decahydropicene-4a-carboxylate is [C-]#[N+]C1=C[C@]2(C)C3=CC(=O)[C@@H]4[C@@H]5CC(C)(C)CC[C@]5(C(=O)OC)CC[C@@]4(C)[C@]3(C)CC[C@H]2[C@](C)(CCOC)C1=O.[C-]#[N+]C1=C[C@]2(C)C3=CC(=O)[C@@H]4[C@@H]5CC(C)(C)CC[C@]5(C(=O)OC)CC[C@@]4(C)[C@]3(C)CC[C@H]2[C@](C)(CCO[Si](C)(C)C(C)(C)C)C1=O.[C-]#[N+]C1=C[C@]2(C)C3=CC(=O)[C@@H]4[C@@H]5CC(C)(C)CC[C@]5(C(=O)OC)CC[C@@]4(C)[C@]3(C)CC[C@H]2[C@](C)(COC(=O)c2ccccc2)C1=O.[C-]#[N+]C1=C[C@]2(C)C3=CC(=O)[C@@H]4[C@@H]5CC(C)(C)CC[C@]5(C(=O)OC)CC[C@@]4(C)[C@]3(C)CC[C@H]2[C@](C)(COC(C)=O)C1=O.

What is the InChIKey of methyl (4aS,6aR,6bS,8aR,9R,12aR,14aR,14bS)-9-(acetyloxymethyl)-11-isocyano-2,2,6a,6b,9,12a-hexamethyl-10,14-dioxo-1,3,4,5,6,7,8,8a,14a,14b-decahydropicene-4a-carboxylate;methyl (4aS,6aR,6bS,8aR,9R,12aR,14aR,14bS)-9-(benzoyloxymethyl)-11-isocyano-2,2,6a,6b,9,12a-hexamethyl-10,14-dioxo-1,3,4,5,6,7,8,8a,14a,14b-decahydropicene-4a-carboxylate;methyl (4aS,6aR,6bS,8aR,9S,12aR,14aR,14bS)-9-[2-[tert-butyl(dimethyl)silyl]oxyethyl]-11-isocyano-2,2,6a,6b,9,12a-hexamethyl-10,14-dioxo-1,3,4,5,6,7,8,8a,14a,14b-decahydropicene-4a-carboxylate;methyl (4aS,6aR,6bS,8aR,9S,12aR,14aR,14bS)-11-isocyano-9-(2-methoxyethyl)-2,2,6a,6b,9,12a-hexamethyl-10,14-dioxo-1,3,4,5,6,7,8,8a,14a,14b-decahydropicene-4a-carboxylate?

The InChIKey is AOFLOIPZTVRDPU-ZRRARFRMSA-N. The full InChI is InChI=1S/C39H47NO6.C39H59NO5Si.C34H45NO6.C34H47NO5/c1-34(2)16-18-39(33(44)45-8)19-17-38(6)30(25(39)21-34)27(41)20-29-35(3)22-26(40-7)31(42)36(4,28(35)14-15-37(29,38)5)23-46-32(43)24-12-10-9-11-13-24;1-33(2,3)46(12,13)45-21-20-35(6)28-14-15-37(8)29(36(28,7)24-26(40-10)31(35)42)22-27(41)30-25-23-34(4,5)16-18-39(25,32(43)44-11)19-17-38(30,37)9;1-20(36)41-19-31(5)24-10-11-32(6)25(30(24,4)18-22(35-8)27(31)38)16-23(37)26-21-17-29(2,3)12-14-34(21,28(39)40-9)15-13-33(26,32)7;1-29(2)12-14-34(28(38)40-9)15-13-33(6)26(21(34)19-29)23(36)18-25-31(4)20-22(35-7)27(37)30(3,16-17-39-8)24(31)10-11-32(25,33)5/h9-13,20,22,25,28,30H,14-19,21,23H2,1-6,8H3;22,24-25,28,30H,14-21,23H2,1-9,11-13H3;16,18,21,24,26H,10-15,17,19H2,1-7,9H3;18,20-21,24,26H,10-17,19H2,1-6,8-9H3/t25-,28+,30-,35-,36-,37+,38+,39-;25-,28-,30-,35-,36-,37+,38+,39-;21-,24+,26-,30-,31-,32+,33+,34-;21-,24-,26-,30-,31-,32+,33+,34-/m0000/s1.

What are the key properties of methyl (4aS,6aR,6bS,8aR,9R,12aR,14aR,14bS)-9-(acetyloxymethyl)-11-isocyano-2,2,6a,6b,9,12a-hexamethyl-10,14-dioxo-1,3,4,5,6,7,8,8a,14a,14b-decahydropicene-4a-carboxylate;methyl (4aS,6aR,6bS,8aR,9R,12aR,14aR,14bS)-9-(benzoyloxymethyl)-11-isocyano-2,2,6a,6b,9,12a-hexamethyl-10,14-dioxo-1,3,4,5,6,7,8,8a,14a,14b-decahydropicene-4a-carboxylate;methyl (4aS,6aR,6bS,8aR,9S,12aR,14aR,14bS)-9-[2-[tert-butyl(dimethyl)silyl]oxyethyl]-11-isocyano-2,2,6a,6b,9,12a-hexamethyl-10,14-dioxo-1,3,4,5,6,7,8,8a,14a,14b-decahydropicene-4a-carboxylate;methyl (4aS,6aR,6bS,8aR,9S,12aR,14aR,14bS)-11-isocyano-9-(2-methoxyethyl)-2,2,6a,6b,9,12a-hexamethyl-10,14-dioxo-1,3,4,5,6,7,8,8a,14a,14b-decahydropicene-4a-carboxylate?

methyl (4aS,6aR,6bS,8aR,9R,12aR,14aR,14bS)-9-(acetyloxymethyl)-11-isocyano-2,2,6a,6b,9,12a-hexamethyl-10,14-dioxo-1,3,4,5,6,7,8,8a,14a,14b-decahydropicene-4a-carboxylate;methyl (4aS,6aR,6bS,8aR,9R,12aR,14aR,14bS)-9-(benzoyloxymethyl)-11-isocyano-2,2,6a,6b,9,12a-hexamethyl-10,14-dioxo-1,3,4,5,6,7,8,8a,14a,14b-decahydropicene-4a-carboxylate;methyl (4aS,6aR,6bS,8aR,9S,12aR,14aR,14bS)-9-[2-[tert-butyl(dimethyl)silyl]oxyethyl]-11-isocyano-2,2,6a,6b,9,12a-hexamethyl-10,14-dioxo-1,3,4,5,6,7,8,8a,14a,14b-decahydropicene-4a-carboxylate;methyl (4aS,6aR,6bS,8aR,9S,12aR,14aR,14bS)-11-isocyano-9-(2-methoxyethyl)-2,2,6a,6b,9,12a-hexamethyl-10,14-dioxo-1,3,4,5,6,7,8,8a,14a,14b-decahydropicene-4a-carboxylate has a molecular weight of 2389.28 g/mol, XLogP of 29.72, 16 rotatable bonds, 0 hydrogen bond donors, and 22 hydrogen bond acceptors.

Where does this data come from?

All data for methyl (4aS,6aR,6bS,8aR,9R,12aR,14aR,14bS)-9-(acetyloxymethyl)-11-isocyano-2,2,6a,6b,9,12a-hexamethyl-10,14-dioxo-1,3,4,5,6,7,8,8a,14a,14b-decahydropicene-4a-carboxylate;methyl (4aS,6aR,6bS,8aR,9R,12aR,14aR,14bS)-9-(benzoyloxymethyl)-11-isocyano-2,2,6a,6b,9,12a-hexamethyl-10,14-dioxo-1,3,4,5,6,7,8,8a,14a,14b-decahydropicene-4a-carboxylate;methyl (4aS,6aR,6bS,8aR,9S,12aR,14aR,14bS)-9-[2-[tert-butyl(dimethyl)silyl]oxyethyl]-11-isocyano-2,2,6a,6b,9,12a-hexamethyl-10,14-dioxo-1,3,4,5,6,7,8,8a,14a,14b-decahydropicene-4a-carboxylate;methyl (4aS,6aR,6bS,8aR,9S,12aR,14aR,14bS)-11-isocyano-9-(2-methoxyethyl)-2,2,6a,6b,9,12a-hexamethyl-10,14-dioxo-1,3,4,5,6,7,8,8a,14a,14b-decahydropicene-4a-carboxylate is sourced from PubChem (CID 157177827), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).