(2R,9aR)-2'-amino-7-(5-chloro-3-pyridinyl)-2-ethoxy-3'-methylspiro[1,2,3,4,4a,9a-hexahydroxanthene-9,5'-imidazole]-4'-one;5-[(7R,8aR)-2'-amino-7-(cyclopropylmethoxy)-1'-methyl-5'-oxospiro[5,6,7,8,8a,10a-hexahydroxanthene-9,4'-imidazole]-2-yl]pyridine-3-carbonitrile;(2R,9aR)-2'-amino-2-ethoxy-7-(2-fluoro-3-pyridinyl)-3'-methylspiro[1,2,3,4,4a,9a-hexahydroxanthene-9,5'-imidazole]-4'-one;3-[(7R,8aR)-2'-amino-7-ethoxy-1'-methyl-5'-oxospiro[5,6,7,8,8a,10a-hexahydroxanthene-9,4'-imidazole]-2-yl]-5-fluorobenzonitrile;(10aS)-2'-amino-8-(2-fluoro-3-pyridinyl)-3'-methylspiro[3,4,4a,10a-tetrahydro-2H-pyrano[3,2-b]chromene-10,5'-imidazole]-4'-one;(10R,10aR)-2'-amino-8-(2-fluoro-3-pyridinyl)-3'-methylspiro[3,4,4a,10a-tetrahydro-1H-pyrano[4,3-b]chromene-10,5'-imidazole]-4'-one;(10aS)-2'-amino-8-methoxy-3'-methylspiro[3,4,4a,10a-tetrahydro-1H-pyrano[4,3-b]chromene-10,5'-imidazole]-4'-one

C153H159ClF4N28O22 — CID 159975838

About (2R,9aR)-2'-amino-7-(5-chloro-3-pyridinyl)-2-ethoxy-3'-methylspiro[1,2,3,4,4a,9a-hexahydroxanthene-9,5'-imidazole]-4'-one;5-[(7R,8aR)-2'-amino-7-(cyclopropylmethoxy)-1'-methyl-5'-oxospiro[5,6,7,8,8a,10a-hexahydroxanthene-9,4'-imidazole]-2-yl]pyridine-3-carbonitrile;(2R,9aR)-2'-amino-2-ethoxy-7-(2-fluoro-3-pyridinyl)-3'-methylspiro[1,2,3,4,4a,9a-hexahydroxanthene-9,5'-imidazole]-4'-one;3-[(7R,8aR)-2'-amino-7-ethoxy-1'-methyl-5'-oxospiro[5,6,7,8,8a,10a-hexahydroxanthene-9,4'-imidazole]-2-yl]-5-fluorobenzonitrile;(10aS)-2'-amino-8-(2-fluoro-3-pyridinyl)-3'-methylspiro[3,4,4a,10a-tetrahydro-2H-pyrano[3,2-b]chromene-10,5'-imidazole]-4'-one;(10R,10aR)-2'-amino-8-(2-fluoro-3-pyridinyl)-3'-methylspiro[3,4,4a,10a-tetrahydro-1H-pyrano[4,3-b]chromene-10,5'-imidazole]-4'-one;(10aS)-2'-amino-8-methoxy-3'-methylspiro[3,4,4a,10a-tetrahydro-1H-pyrano[4,3-b]chromene-10,5'-imidazole]-4'-one

(2R,9aR)-2'-amino-7-(5-chloro-3-pyridinyl)-2-ethoxy-3'-methylspiro[1,2,3,4,4a,9a-hexahydroxanthene-9,5'-imidazole]-4'-one;5-[(7R,8aR)-2'-amino-7-(cyclopropylmethoxy)-1'-methyl-5'-oxospiro[5,6,7,8,8a,10a-hexahydroxanthene-9,4'-imidazole]-2-yl]pyridine-3-carbonitrile;(2R,9aR)-2'-amino-2-ethoxy-7-(2-fluoro-3-pyridinyl)-3'-methylspiro[1,2,3,4,4a,9a-hexahydroxanthene-9,5'-imidazole]-4'-one;3-[(7R,8aR)-2'-amino-7-ethoxy-1'-methyl-5'-oxospiro[5,6,7,8,8a,10a-hexahydroxanthene-9,4'-imidazole]-2-yl]-5-fluorobenzonitrile;(10aS)-2'-amino-8-(2-fluoro-3-pyridinyl)-3'-methylspiro[3,4,4a,10a-tetrahydro-2H-pyrano[3,2-b]chromene-10,5'-imidazole]-4'-one;(10R,10aR)-2'-amino-8-(2-fluoro-3-pyridinyl)-3'-methylspiro[3,4,4a,10a-tetrahydro-1H-pyrano[4,3-b]chromene-10,5'-imidazole]-4'-one;(10aS)-2'-amino-8-methoxy-3'-methylspiro[3,4,4a,10a-tetrahydro-1H-pyrano[4,3-b]chromene-10,5'-imidazole]-4'-one (PubChem CID 159975838) has the molecular formula C153H159ClF4N28O22 and a molecular weight of 2853.57 g/mol. Its IUPAC name is (2R,9aR)-2'-amino-7-(5-chloro-3-pyridinyl)-2-ethoxy-3'-methylspiro[1,2,3,4,4a,9a-hexahydroxanthene-9,5'-imidazole]-4'-one;5-[(7R,8aR)-2'-amino-7-(cyclopropylmethoxy)-1'-methyl-5'-oxospiro[5,6,7,8,8a,10a-hexahydroxanthene-9,4'-imidazole]-2-yl]pyridine-3-carbonitrile;(2R,9aR)-2'-amino-2-ethoxy-7-(2-fluoro-3-pyridinyl)-3'-methylspiro[1,2,3,4,4a,9a-hexahydroxanthene-9,5'-imidazole]-4'-one;3-[(7R,8aR)-2'-amino-7-ethoxy-1'-methyl-5'-oxospiro[5,6,7,8,8a,10a-hexahydroxanthene-9,4'-imidazole]-2-yl]-5-fluorobenzonitrile;(10aS)-2'-amino-8-(2-fluoro-3-pyridinyl)-3'-methylspiro[3,4,4a,10a-tetrahydro-2H-pyrano[3,2-b]chromene-10,5'-imidazole]-4'-one;(10R,10aR)-2'-amino-8-(2-fluoro-3-pyridinyl)-3'-methylspiro[3,4,4a,10a-tetrahydro-1H-pyrano[4,3-b]chromene-10,5'-imidazole]-4'-one;(10aS)-2'-amino-8-methoxy-3'-methylspiro[3,4,4a,10a-tetrahydro-1H-pyrano[4,3-b]chromene-10,5'-imidazole]-4'-one.

Molecular Properties

• Compound Name: (2R,9aR)-2'-amino-7-(5-chloro-3-pyridinyl)-2-ethoxy-3'-methylspiro[1,2,3,4,4a,9a-hexahydroxanthene-9,5'-imidazole]-4'-one;5-[(7R,8aR)-2'-amino-7-(cyclopropylmethoxy)-1'-methyl-5'-oxospiro[5,6,7,8,8a,10a-hexahydroxanthene-9,4'-imidazole]-2-yl]pyridine-3-carbonitrile;(2R,9aR)-2'-amino-2-ethoxy-7-(2-fluoro-3-pyridinyl)-3'-methylspiro[1,2,3,4,4a,9a-hexahydroxanthene-9,5'-imidazole]-4'-one;3-[(7R,8aR)-2'-amino-7-ethoxy-1'-methyl-5'-oxospiro[5,6,7,8,8a,10a-hexahydroxanthene-9,4'-imidazole]-2-yl]-5-fluorobenzonitrile;(10aS)-2'-amino-8-(2-fluoro-3-pyridinyl)-3'-methylspiro[3,4,4a,10a-tetrahydro-2H-pyrano[3,2-b]chromene-10,5'-imidazole]-4'-one;(10R,10aR)-2'-amino-8-(2-fluoro-3-pyridinyl)-3'-methylspiro[3,4,4a,10a-tetrahydro-1H-pyrano[4,3-b]chromene-10,5'-imidazole]-4'-one;(10aS)-2'-amino-8-methoxy-3'-methylspiro[3,4,4a,10a-tetrahydro-1H-pyrano[4,3-b]chromene-10,5'-imidazole]-4'-one
• PubChem CID: 159975838
• Molecular Formula: C153H159ClF4N28O22
• Molecular Weight: 2853.57 g/mol
• Exact Mass: 2851.18
• IUPAC Name: (2R,9aR)-2'-amino-7-(5-chloro-3-pyridinyl)-2-ethoxy-3'-methylspiro[1,2,3,4,4a,9a-hexahydroxanthene-9,5'-imidazole]-4'-one;5-[(7R,8aR)-2'-amino-7-(cyclopropylmethoxy)-1'-methyl-5'-oxospiro[5,6,7,8,8a,10a-hexahydroxanthene-9,4'-imidazole]-2-yl]pyridine-3-carbonitrile;(2R,9aR)-2'-amino-2-ethoxy-7-(2-fluoro-3-pyridinyl)-3'-methylspiro[1,2,3,4,4a,9a-hexahydroxanthene-9,5'-imidazole]-4'-one;3-[(7R,8aR)-2'-amino-7-ethoxy-1'-methyl-5'-oxospiro[5,6,7,8,8a,10a-hexahydroxanthene-9,4'-imidazole]-2-yl]-5-fluorobenzonitrile;(10aS)-2'-amino-8-(2-fluoro-3-pyridinyl)-3'-methylspiro[3,4,4a,10a-tetrahydro-2H-pyrano[3,2-b]chromene-10,5'-imidazole]-4'-one;(10R,10aR)-2'-amino-8-(2-fluoro-3-pyridinyl)-3'-methylspiro[3,4,4a,10a-tetrahydro-1H-pyrano[4,3-b]chromene-10,5'-imidazole]-4'-one;(10aS)-2'-amino-8-methoxy-3'-methylspiro[3,4,4a,10a-tetrahydro-1H-pyrano[4,3-b]chromene-10,5'-imidazole]-4'-one
• SMILES: CCO[C@@H]1CCC2Oc3ccc(-c4cc(F)cc(C#N)c4)cc3C3(N=C(N)N(C)C3=O)[C@H]2C1.CCO[C@@H]1CCC2Oc3ccc(-c4cccnc4F)cc3C3(N=C(N)N(C)C3=O)[C@H]2C1.CCO[C@@H]1CCC2Oc3ccc(-c4cncc(Cl)c4)cc3C3(N=C(N)N(C)C3=O)[C@H]2C1.CN1C(=O)C2(N=C1N)c1cc(-c3cccnc3F)ccc1OC1CCCO[C@H]12.CN1C(=O)C2(N=C1N)c1cc(-c3cncc(C#N)c3)ccc1OC1CC[C@@H](OCC3CC3)C[C@@H]12.CN1C(=O)[C@]2(N=C1N)c1cc(-c3cccnc3F)ccc1OC1CCOC[C@H]12.COc1ccc2c(c1)C1(N=C(N)N(C)C1=O)[C@H]1COCCC1O2
• InChI: InChI=1S/C26H27N5O3.C25H25FN4O3.C23H25ClN4O3.C23H25FN4O3.2C20H19FN4O3.C16H19N3O4/c1-31-24(32)26(30-25(31)28)20-9-17(18-8-16(11-27)12-29-13-18)4-6-22(20)34-23-7-5-19(10-21(23)26)33-14-15-2-3-15;1-3-32-18-5-7-22-20(12-18)25(23(31)30(2)24(28)29-25)19-11-15(4-6-21(19)33-22)16-8-14(13-27)9-17(26)10-16;1-3-30-16-5-7-20-18(10-16)23(21(29)28(2)22(25)27-23)17-9-13(4-6-19(17)31-20)14-8-15(24)12-26-11-14;1-3-30-14-7-9-19-17(12-14)23(21(29)28(2)22(25)27-23)16-11-13(6-8-18(16)31-19)15-5-4-10-26-20(15)24;1-25-18(26)20(24-19(25)22)13-10-11(12-4-2-8-23-17(12)21)6-7-14(13)28-15-5-3-9-27-16(15)20;1-25-18(26)20(24-19(25)22)13-9-11(12-3-2-7-23-17(12)21)4-5-15(13)28-16-6-8-27-10-14(16)20;1-19-14(20)16(18-15(19)17)10-7-9(21-2)3-4-12(10)23-13-5-6-22-8-11(13)16/h4,6,8-9,12-13,15,19,21,23H,2-3,5,7,10,14H2,1H3,(H2,28,30);4,6,8-11,18,20,22H,3,5,7,12H2,1-2H3,(H2,28,29);4,6,8-9,11-12,16,18,20H,3,5,7,10H2,1-2H3,(H2,25,27);4-6,8,10-11,14,17,19H,3,7,9,12H2,1-2H3,(H2,25,27);2,4,6-8,10,15-16H,3,5,9H2,1H3,(H2,22,24);2-5,7,9,14,16H,6,8,10H2,1H3,(H2,22,24);3-4,7,11,13H,5-6,8H2,1-2H3,(H2,17,18)/t19-,21+,23?,26?;18-,20+,22?,25?;16-,18+,20?,23?;14-,17+,19?,23?;15?,16-,20?;14-,16?,20+;11-,13?,16?/m1111110/s1
• InChIKey: OFDKZJRQULQDKO-XPAZYUFASA-N
• XLogP: 16.41
• TPSA: 661.31 Ų
• H-Bond Donors: 7
• H-Bond Acceptors: 43
• Rotatable Bonds: 16
• Heavy Atoms: 208
• Complexity: —

Lipinski Rule of Five

4 violations

Rule	Value
MW ≤ 500	2853.57
LogP ≤ 5	16.41
H-Bond Donors ≤ 5	7
H-Bond Acceptors ≤ 10	43

Computed Properties (RDKit)

• Structural Alerts: {'alert_name': '2-halo_pyridine', 'substructure': 'N/A'}

Frequently Asked Questions

What is the IUPAC name of (2R,9aR)-2'-amino-7-(5-chloro-3-pyridinyl)-2-ethoxy-3'-methylspiro[1,2,3,4,4a,9a-hexahydroxanthene-9,5'-imidazole]-4'-one;5-[(7R,8aR)-2'-amino-7-(cyclopropylmethoxy)-1'-methyl-5'-oxospiro[5,6,7,8,8a,10a-hexahydroxanthene-9,4'-imidazole]-2-yl]pyridine-3-carbonitrile;(2R,9aR)-2'-amino-2-ethoxy-7-(2-fluoro-3-pyridinyl)-3'-methylspiro[1,2,3,4,4a,9a-hexahydroxanthene-9,5'-imidazole]-4'-one;3-[(7R,8aR)-2'-amino-7-ethoxy-1'-methyl-5'-oxospiro[5,6,7,8,8a,10a-hexahydroxanthene-9,4'-imidazole]-2-yl]-5-fluorobenzonitrile;(10aS)-2'-amino-8-(2-fluoro-3-pyridinyl)-3'-methylspiro[3,4,4a,10a-tetrahydro-2H-pyrano[3,2-b]chromene-10,5'-imidazole]-4'-one;(10R,10aR)-2'-amino-8-(2-fluoro-3-pyridinyl)-3'-methylspiro[3,4,4a,10a-tetrahydro-1H-pyrano[4,3-b]chromene-10,5'-imidazole]-4'-one;(10aS)-2'-amino-8-methoxy-3'-methylspiro[3,4,4a,10a-tetrahydro-1H-pyrano[4,3-b]chromene-10,5'-imidazole]-4'-one?

The IUPAC name of (2R,9aR)-2'-amino-7-(5-chloro-3-pyridinyl)-2-ethoxy-3'-methylspiro[1,2,3,4,4a,9a-hexahydroxanthene-9,5'-imidazole]-4'-one;5-[(7R,8aR)-2'-amino-7-(cyclopropylmethoxy)-1'-methyl-5'-oxospiro[5,6,7,8,8a,10a-hexahydroxanthene-9,4'-imidazole]-2-yl]pyridine-3-carbonitrile;(2R,9aR)-2'-amino-2-ethoxy-7-(2-fluoro-3-pyridinyl)-3'-methylspiro[1,2,3,4,4a,9a-hexahydroxanthene-9,5'-imidazole]-4'-one;3-[(7R,8aR)-2'-amino-7-ethoxy-1'-methyl-5'-oxospiro[5,6,7,8,8a,10a-hexahydroxanthene-9,4'-imidazole]-2-yl]-5-fluorobenzonitrile;(10aS)-2'-amino-8-(2-fluoro-3-pyridinyl)-3'-methylspiro[3,4,4a,10a-tetrahydro-2H-pyrano[3,2-b]chromene-10,5'-imidazole]-4'-one;(10R,10aR)-2'-amino-8-(2-fluoro-3-pyridinyl)-3'-methylspiro[3,4,4a,10a-tetrahydro-1H-pyrano[4,3-b]chromene-10,5'-imidazole]-4'-one;(10aS)-2'-amino-8-methoxy-3'-methylspiro[3,4,4a,10a-tetrahydro-1H-pyrano[4,3-b]chromene-10,5'-imidazole]-4'-one (CID 159975838) is (2R,9aR)-2'-amino-7-(5-chloro-3-pyridinyl)-2-ethoxy-3'-methylspiro[1,2,3,4,4a,9a-hexahydroxanthene-9,5'-imidazole]-4'-one;5-[(7R,8aR)-2'-amino-7-(cyclopropylmethoxy)-1'-methyl-5'-oxospiro[5,6,7,8,8a,10a-hexahydroxanthene-9,4'-imidazole]-2-yl]pyridine-3-carbonitrile;(2R,9aR)-2'-amino-2-ethoxy-7-(2-fluoro-3-pyridinyl)-3'-methylspiro[1,2,3,4,4a,9a-hexahydroxanthene-9,5'-imidazole]-4'-one;3-[(7R,8aR)-2'-amino-7-ethoxy-1'-methyl-5'-oxospiro[5,6,7,8,8a,10a-hexahydroxanthene-9,4'-imidazole]-2-yl]-5-fluorobenzonitrile;(10aS)-2'-amino-8-(2-fluoro-3-pyridinyl)-3'-methylspiro[3,4,4a,10a-tetrahydro-2H-pyrano[3,2-b]chromene-10,5'-imidazole]-4'-one;(10R,10aR)-2'-amino-8-(2-fluoro-3-pyridinyl)-3'-methylspiro[3,4,4a,10a-tetrahydro-1H-pyrano[4,3-b]chromene-10,5'-imidazole]-4'-one;(10aS)-2'-amino-8-methoxy-3'-methylspiro[3,4,4a,10a-tetrahydro-1H-pyrano[4,3-b]chromene-10,5'-imidazole]-4'-one.

What is the SMILES notation for (2R,9aR)-2'-amino-7-(5-chloro-3-pyridinyl)-2-ethoxy-3'-methylspiro[1,2,3,4,4a,9a-hexahydroxanthene-9,5'-imidazole]-4'-one;5-[(7R,8aR)-2'-amino-7-(cyclopropylmethoxy)-1'-methyl-5'-oxospiro[5,6,7,8,8a,10a-hexahydroxanthene-9,4'-imidazole]-2-yl]pyridine-3-carbonitrile;(2R,9aR)-2'-amino-2-ethoxy-7-(2-fluoro-3-pyridinyl)-3'-methylspiro[1,2,3,4,4a,9a-hexahydroxanthene-9,5'-imidazole]-4'-one;3-[(7R,8aR)-2'-amino-7-ethoxy-1'-methyl-5'-oxospiro[5,6,7,8,8a,10a-hexahydroxanthene-9,4'-imidazole]-2-yl]-5-fluorobenzonitrile;(10aS)-2'-amino-8-(2-fluoro-3-pyridinyl)-3'-methylspiro[3,4,4a,10a-tetrahydro-2H-pyrano[3,2-b]chromene-10,5'-imidazole]-4'-one;(10R,10aR)-2'-amino-8-(2-fluoro-3-pyridinyl)-3'-methylspiro[3,4,4a,10a-tetrahydro-1H-pyrano[4,3-b]chromene-10,5'-imidazole]-4'-one;(10aS)-2'-amino-8-methoxy-3'-methylspiro[3,4,4a,10a-tetrahydro-1H-pyrano[4,3-b]chromene-10,5'-imidazole]-4'-one?

The canonical SMILES for (2R,9aR)-2'-amino-7-(5-chloro-3-pyridinyl)-2-ethoxy-3'-methylspiro[1,2,3,4,4a,9a-hexahydroxanthene-9,5'-imidazole]-4'-one;5-[(7R,8aR)-2'-amino-7-(cyclopropylmethoxy)-1'-methyl-5'-oxospiro[5,6,7,8,8a,10a-hexahydroxanthene-9,4'-imidazole]-2-yl]pyridine-3-carbonitrile;(2R,9aR)-2'-amino-2-ethoxy-7-(2-fluoro-3-pyridinyl)-3'-methylspiro[1,2,3,4,4a,9a-hexahydroxanthene-9,5'-imidazole]-4'-one;3-[(7R,8aR)-2'-amino-7-ethoxy-1'-methyl-5'-oxospiro[5,6,7,8,8a,10a-hexahydroxanthene-9,4'-imidazole]-2-yl]-5-fluorobenzonitrile;(10aS)-2'-amino-8-(2-fluoro-3-pyridinyl)-3'-methylspiro[3,4,4a,10a-tetrahydro-2H-pyrano[3,2-b]chromene-10,5'-imidazole]-4'-one;(10R,10aR)-2'-amino-8-(2-fluoro-3-pyridinyl)-3'-methylspiro[3,4,4a,10a-tetrahydro-1H-pyrano[4,3-b]chromene-10,5'-imidazole]-4'-one;(10aS)-2'-amino-8-methoxy-3'-methylspiro[3,4,4a,10a-tetrahydro-1H-pyrano[4,3-b]chromene-10,5'-imidazole]-4'-one is CCO[C@@H]1CCC2Oc3ccc(-c4cc(F)cc(C#N)c4)cc3C3(N=C(N)N(C)C3=O)[C@H]2C1.CCO[C@@H]1CCC2Oc3ccc(-c4cccnc4F)cc3C3(N=C(N)N(C)C3=O)[C@H]2C1.CCO[C@@H]1CCC2Oc3ccc(-c4cncc(Cl)c4)cc3C3(N=C(N)N(C)C3=O)[C@H]2C1.CN1C(=O)C2(N=C1N)c1cc(-c3cccnc3F)ccc1OC1CCCO[C@H]12.CN1C(=O)C2(N=C1N)c1cc(-c3cncc(C#N)c3)ccc1OC1CC[C@@H](OCC3CC3)C[C@@H]12.CN1C(=O)[C@]2(N=C1N)c1cc(-c3cccnc3F)ccc1OC1CCOC[C@H]12.COc1ccc2c(c1)C1(N=C(N)N(C)C1=O)[C@H]1COCCC1O2.

What is the InChIKey of (2R,9aR)-2'-amino-7-(5-chloro-3-pyridinyl)-2-ethoxy-3'-methylspiro[1,2,3,4,4a,9a-hexahydroxanthene-9,5'-imidazole]-4'-one;5-[(7R,8aR)-2'-amino-7-(cyclopropylmethoxy)-1'-methyl-5'-oxospiro[5,6,7,8,8a,10a-hexahydroxanthene-9,4'-imidazole]-2-yl]pyridine-3-carbonitrile;(2R,9aR)-2'-amino-2-ethoxy-7-(2-fluoro-3-pyridinyl)-3'-methylspiro[1,2,3,4,4a,9a-hexahydroxanthene-9,5'-imidazole]-4'-one;3-[(7R,8aR)-2'-amino-7-ethoxy-1'-methyl-5'-oxospiro[5,6,7,8,8a,10a-hexahydroxanthene-9,4'-imidazole]-2-yl]-5-fluorobenzonitrile;(10aS)-2'-amino-8-(2-fluoro-3-pyridinyl)-3'-methylspiro[3,4,4a,10a-tetrahydro-2H-pyrano[3,2-b]chromene-10,5'-imidazole]-4'-one;(10R,10aR)-2'-amino-8-(2-fluoro-3-pyridinyl)-3'-methylspiro[3,4,4a,10a-tetrahydro-1H-pyrano[4,3-b]chromene-10,5'-imidazole]-4'-one;(10aS)-2'-amino-8-methoxy-3'-methylspiro[3,4,4a,10a-tetrahydro-1H-pyrano[4,3-b]chromene-10,5'-imidazole]-4'-one?

The InChIKey is OFDKZJRQULQDKO-XPAZYUFASA-N. The full InChI is InChI=1S/C26H27N5O3.C25H25FN4O3.C23H25ClN4O3.C23H25FN4O3.2C20H19FN4O3.C16H19N3O4/c1-31-24(32)26(30-25(31)28)20-9-17(18-8-16(11-27)12-29-13-18)4-6-22(20)34-23-7-5-19(10-21(23)26)33-14-15-2-3-15;1-3-32-18-5-7-22-20(12-18)25(23(31)30(2)24(28)29-25)19-11-15(4-6-21(19)33-22)16-8-14(13-27)9-17(26)10-16;1-3-30-16-5-7-20-18(10-16)23(21(29)28(2)22(25)27-23)17-9-13(4-6-19(17)31-20)14-8-15(24)12-26-11-14;1-3-30-14-7-9-19-17(12-14)23(21(29)28(2)22(25)27-23)16-11-13(6-8-18(16)31-19)15-5-4-10-26-20(15)24;1-25-18(26)20(24-19(25)22)13-10-11(12-4-2-8-23-17(12)21)6-7-14(13)28-15-5-3-9-27-16(15)20;1-25-18(26)20(24-19(25)22)13-9-11(12-3-2-7-23-17(12)21)4-5-15(13)28-16-6-8-27-10-14(16)20;1-19-14(20)16(18-15(19)17)10-7-9(21-2)3-4-12(10)23-13-5-6-22-8-11(13)16/h4,6,8-9,12-13,15,19,21,23H,2-3,5,7,10,14H2,1H3,(H2,28,30);4,6,8-11,18,20,22H,3,5,7,12H2,1-2H3,(H2,28,29);4,6,8-9,11-12,16,18,20H,3,5,7,10H2,1-2H3,(H2,25,27);4-6,8,10-11,14,17,19H,3,7,9,12H2,1-2H3,(H2,25,27);2,4,6-8,10,15-16H,3,5,9H2,1H3,(H2,22,24);2-5,7,9,14,16H,6,8,10H2,1H3,(H2,22,24);3-4,7,11,13H,5-6,8H2,1-2H3,(H2,17,18)/t19-,21+,23?,26?;18-,20+,22?,25?;16-,18+,20?,23?;14-,17+,19?,23?;15?,16-,20?;14-,16?,20+;11-,13?,16?/m1111110/s1.

What are the key properties of (2R,9aR)-2'-amino-7-(5-chloro-3-pyridinyl)-2-ethoxy-3'-methylspiro[1,2,3,4,4a,9a-hexahydroxanthene-9,5'-imidazole]-4'-one;5-[(7R,8aR)-2'-amino-7-(cyclopropylmethoxy)-1'-methyl-5'-oxospiro[5,6,7,8,8a,10a-hexahydroxanthene-9,4'-imidazole]-2-yl]pyridine-3-carbonitrile;(2R,9aR)-2'-amino-2-ethoxy-7-(2-fluoro-3-pyridinyl)-3'-methylspiro[1,2,3,4,4a,9a-hexahydroxanthene-9,5'-imidazole]-4'-one;3-[(7R,8aR)-2'-amino-7-ethoxy-1'-methyl-5'-oxospiro[5,6,7,8,8a,10a-hexahydroxanthene-9,4'-imidazole]-2-yl]-5-fluorobenzonitrile;(10aS)-2'-amino-8-(2-fluoro-3-pyridinyl)-3'-methylspiro[3,4,4a,10a-tetrahydro-2H-pyrano[3,2-b]chromene-10,5'-imidazole]-4'-one;(10R,10aR)-2'-amino-8-(2-fluoro-3-pyridinyl)-3'-methylspiro[3,4,4a,10a-tetrahydro-1H-pyrano[4,3-b]chromene-10,5'-imidazole]-4'-one;(10aS)-2'-amino-8-methoxy-3'-methylspiro[3,4,4a,10a-tetrahydro-1H-pyrano[4,3-b]chromene-10,5'-imidazole]-4'-one?

(2R,9aR)-2'-amino-7-(5-chloro-3-pyridinyl)-2-ethoxy-3'-methylspiro[1,2,3,4,4a,9a-hexahydroxanthene-9,5'-imidazole]-4'-one;5-[(7R,8aR)-2'-amino-7-(cyclopropylmethoxy)-1'-methyl-5'-oxospiro[5,6,7,8,8a,10a-hexahydroxanthene-9,4'-imidazole]-2-yl]pyridine-3-carbonitrile;(2R,9aR)-2'-amino-2-ethoxy-7-(2-fluoro-3-pyridinyl)-3'-methylspiro[1,2,3,4,4a,9a-hexahydroxanthene-9,5'-imidazole]-4'-one;3-[(7R,8aR)-2'-amino-7-ethoxy-1'-methyl-5'-oxospiro[5,6,7,8,8a,10a-hexahydroxanthene-9,4'-imidazole]-2-yl]-5-fluorobenzonitrile;(10aS)-2'-amino-8-(2-fluoro-3-pyridinyl)-3'-methylspiro[3,4,4a,10a-tetrahydro-2H-pyrano[3,2-b]chromene-10,5'-imidazole]-4'-one;(10R,10aR)-2'-amino-8-(2-fluoro-3-pyridinyl)-3'-methylspiro[3,4,4a,10a-tetrahydro-1H-pyrano[4,3-b]chromene-10,5'-imidazole]-4'-one;(10aS)-2'-amino-8-methoxy-3'-methylspiro[3,4,4a,10a-tetrahydro-1H-pyrano[4,3-b]chromene-10,5'-imidazole]-4'-one has a molecular weight of 2853.57 g/mol, XLogP of 16.41, 16 rotatable bonds, 7 hydrogen bond donors, and 43 hydrogen bond acceptors.

Where does this data come from?

All data for (2R,9aR)-2'-amino-7-(5-chloro-3-pyridinyl)-2-ethoxy-3'-methylspiro[1,2,3,4,4a,9a-hexahydroxanthene-9,5'-imidazole]-4'-one;5-[(7R,8aR)-2'-amino-7-(cyclopropylmethoxy)-1'-methyl-5'-oxospiro[5,6,7,8,8a,10a-hexahydroxanthene-9,4'-imidazole]-2-yl]pyridine-3-carbonitrile;(2R,9aR)-2'-amino-2-ethoxy-7-(2-fluoro-3-pyridinyl)-3'-methylspiro[1,2,3,4,4a,9a-hexahydroxanthene-9,5'-imidazole]-4'-one;3-[(7R,8aR)-2'-amino-7-ethoxy-1'-methyl-5'-oxospiro[5,6,7,8,8a,10a-hexahydroxanthene-9,4'-imidazole]-2-yl]-5-fluorobenzonitrile;(10aS)-2'-amino-8-(2-fluoro-3-pyridinyl)-3'-methylspiro[3,4,4a,10a-tetrahydro-2H-pyrano[3,2-b]chromene-10,5'-imidazole]-4'-one;(10R,10aR)-2'-amino-8-(2-fluoro-3-pyridinyl)-3'-methylspiro[3,4,4a,10a-tetrahydro-1H-pyrano[4,3-b]chromene-10,5'-imidazole]-4'-one;(10aS)-2'-amino-8-methoxy-3'-methylspiro[3,4,4a,10a-tetrahydro-1H-pyrano[4,3-b]chromene-10,5'-imidazole]-4'-one is sourced from PubChem (CID 159975838), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).