N-[2-[(3'R,3'aS,4aR,6'S,6aR,6bS,7'aR,9R,11aS,11bS)-3',6',10,11b-tetramethyl-3-oxospiro[1,2,4,4a,5,6,6a,6b,7,8,11,11a-dodecahydrobenzo[a]fluorene-9,2'-3,3a,5,6,7,7a-hexahydrofuro[3,2-b]pyridine]-4'-yl]ethyl]-3-phenylpropanamide;2-[(3'R,3'aS,4aR,6'S,6aR,6bS,7'aR,9R,11aS,11bS)-3',6',10,11b-tetramethyl-3-oxospiro[1,2,4,4a,5,6,6a,6b,7,8,11,11a-dodecahydrobenzo[a]fluorene-9,2'-3,3a,5,6,7,7a-hexahydrofuro[3,2-b]pyridine]-4'-yl]-N-methyl-N-(2-phenylethyl)acetamide;2-[(3'R,3'aS,4aR,6'S,6aR,6bS,7'aR,9R,11aS,11bS)-3',6',10,11b-tetramethyl-3-oxospiro[1,2,4,4a,5,6,6a,6b,7,8,11,11a-dodecahydrobenzo[a]fluorene-9,2'-3,3a,5,6,7,7a-hexahydrofuro[3,2-b]pyridine]-4'-yl]-N-(2-phenylethyl)acetamide;N-[(3S,3'R,3'aS,4aR,6'S,6aR,6bS,7'aR,9R,11aS,11bS)-3',6',10,11b-tetramethylspiro[2,3,4,4a,5,6,6a,6b,7,8,11,11a-dodecahydro-1H-benzo[a]fluorene-9,2'-3a,4,5,6,7,7a-hexahydro-3H-furo[3,2-b]pyridine]-3-yl]methanesulfonamide;N-[(3R,3'R,3'aS,4aR,6'S,6aR,6bS,7'aR,9R,11aS,11bS)-3',6',10,11b-tetramethylspiro[2,3,4,4a,5,6,6a,6b,7,8,11,11a-dodecahydro-1H-benzo[a]fluorene-9,2'-3a,4,5,6,7,7a-hexahydro-3H-furo[3,2-b]pyridine]-3-yl]methanesulfonamide;methane

C170H256N10O15S2 — CID 159886212

About N-[2-[(3'R,3'aS,4aR,6'S,6aR,6bS,7'aR,9R,11aS,11bS)-3',6',10,11b-tetramethyl-3-oxospiro[1,2,4,4a,5,6,6a,6b,7,8,11,11a-dodecahydrobenzo[a]fluorene-9,2'-3,3a,5,6,7,7a-hexahydrofuro[3,2-b]pyridine]-4'-yl]ethyl]-3-phenylpropanamide;2-[(3'R,3'aS,4aR,6'S,6aR,6bS,7'aR,9R,11aS,11bS)-3',6',10,11b-tetramethyl-3-oxospiro[1,2,4,4a,5,6,6a,6b,7,8,11,11a-dodecahydrobenzo[a]fluorene-9,2'-3,3a,5,6,7,7a-hexahydrofuro[3,2-b]pyridine]-4'-yl]-N-methyl-N-(2-phenylethyl)acetamide;2-[(3'R,3'aS,4aR,6'S,6aR,6bS,7'aR,9R,11aS,11bS)-3',6',10,11b-tetramethyl-3-oxospiro[1,2,4,4a,5,6,6a,6b,7,8,11,11a-dodecahydrobenzo[a]fluorene-9,2'-3,3a,5,6,7,7a-hexahydrofuro[3,2-b]pyridine]-4'-yl]-N-(2-phenylethyl)acetamide;N-[(3S,3'R,3'aS,4aR,6'S,6aR,6bS,7'aR,9R,11aS,11bS)-3',6',10,11b-tetramethylspiro[2,3,4,4a,5,6,6a,6b,7,8,11,11a-dodecahydro-1H-benzo[a]fluorene-9,2'-3a,4,5,6,7,7a-hexahydro-3H-furo[3,2-b]pyridine]-3-yl]methanesulfonamide;N-[(3R,3'R,3'aS,4aR,6'S,6aR,6bS,7'aR,9R,11aS,11bS)-3',6',10,11b-tetramethylspiro[2,3,4,4a,5,6,6a,6b,7,8,11,11a-dodecahydro-1H-benzo[a]fluorene-9,2'-3a,4,5,6,7,7a-hexahydro-3H-furo[3,2-b]pyridine]-3-yl]methanesulfonamide;methane

N-[2-[(3'R,3'aS,4aR,6'S,6aR,6bS,7'aR,9R,11aS,11bS)-3',6',10,11b-tetramethyl-3-oxospiro[1,2,4,4a,5,6,6a,6b,7,8,11,11a-dodecahydrobenzo[a]fluorene-9,2'-3,3a,5,6,7,7a-hexahydrofuro[3,2-b]pyridine]-4'-yl]ethyl]-3-phenylpropanamide;2-[(3'R,3'aS,4aR,6'S,6aR,6bS,7'aR,9R,11aS,11bS)-3',6',10,11b-tetramethyl-3-oxospiro[1,2,4,4a,5,6,6a,6b,7,8,11,11a-dodecahydrobenzo[a]fluorene-9,2'-3,3a,5,6,7,7a-hexahydrofuro[3,2-b]pyridine]-4'-yl]-N-methyl-N-(2-phenylethyl)acetamide;2-[(3'R,3'aS,4aR,6'S,6aR,6bS,7'aR,9R,11aS,11bS)-3',6',10,11b-tetramethyl-3-oxospiro[1,2,4,4a,5,6,6a,6b,7,8,11,11a-dodecahydrobenzo[a]fluorene-9,2'-3,3a,5,6,7,7a-hexahydrofuro[3,2-b]pyridine]-4'-yl]-N-(2-phenylethyl)acetamide;N-[(3S,3'R,3'aS,4aR,6'S,6aR,6bS,7'aR,9R,11aS,11bS)-3',6',10,11b-tetramethylspiro[2,3,4,4a,5,6,6a,6b,7,8,11,11a-dodecahydro-1H-benzo[a]fluorene-9,2'-3a,4,5,6,7,7a-hexahydro-3H-furo[3,2-b]pyridine]-3-yl]methanesulfonamide;N-[(3R,3'R,3'aS,4aR,6'S,6aR,6bS,7'aR,9R,11aS,11bS)-3',6',10,11b-tetramethylspiro[2,3,4,4a,5,6,6a,6b,7,8,11,11a-dodecahydro-1H-benzo[a]fluorene-9,2'-3a,4,5,6,7,7a-hexahydro-3H-furo[3,2-b]pyridine]-3-yl]methanesulfonamide;methane (PubChem CID 159886212) has the molecular formula C170H256N10O15S2 and a molecular weight of 2744.11 g/mol. Its IUPAC name is N-[2-[(3'R,3'aS,4aR,6'S,6aR,6bS,7'aR,9R,11aS,11bS)-3',6',10,11b-tetramethyl-3-oxospiro[1,2,4,4a,5,6,6a,6b,7,8,11,11a-dodecahydrobenzo[a]fluorene-9,2'-3,3a,5,6,7,7a-hexahydrofuro[3,2-b]pyridine]-4'-yl]ethyl]-3-phenylpropanamide;2-[(3'R,3'aS,4aR,6'S,6aR,6bS,7'aR,9R,11aS,11bS)-3',6',10,11b-tetramethyl-3-oxospiro[1,2,4,4a,5,6,6a,6b,7,8,11,11a-dodecahydrobenzo[a]fluorene-9,2'-3,3a,5,6,7,7a-hexahydrofuro[3,2-b]pyridine]-4'-yl]-N-methyl-N-(2-phenylethyl)acetamide;2-[(3'R,3'aS,4aR,6'S,6aR,6bS,7'aR,9R,11aS,11bS)-3',6',10,11b-tetramethyl-3-oxospiro[1,2,4,4a,5,6,6a,6b,7,8,11,11a-dodecahydrobenzo[a]fluorene-9,2'-3,3a,5,6,7,7a-hexahydrofuro[3,2-b]pyridine]-4'-yl]-N-(2-phenylethyl)acetamide;N-[(3S,3'R,3'aS,4aR,6'S,6aR,6bS,7'aR,9R,11aS,11bS)-3',6',10,11b-tetramethylspiro[2,3,4,4a,5,6,6a,6b,7,8,11,11a-dodecahydro-1H-benzo[a]fluorene-9,2'-3a,4,5,6,7,7a-hexahydro-3H-furo[3,2-b]pyridine]-3-yl]methanesulfonamide;N-[(3R,3'R,3'aS,4aR,6'S,6aR,6bS,7'aR,9R,11aS,11bS)-3',6',10,11b-tetramethylspiro[2,3,4,4a,5,6,6a,6b,7,8,11,11a-dodecahydro-1H-benzo[a]fluorene-9,2'-3a,4,5,6,7,7a-hexahydro-3H-furo[3,2-b]pyridine]-3-yl]methanesulfonamide;methane.

Molecular Properties

• Compound Name: N-[2-[(3'R,3'aS,4aR,6'S,6aR,6bS,7'aR,9R,11aS,11bS)-3',6',10,11b-tetramethyl-3-oxospiro[1,2,4,4a,5,6,6a,6b,7,8,11,11a-dodecahydrobenzo[a]fluorene-9,2'-3,3a,5,6,7,7a-hexahydrofuro[3,2-b]pyridine]-4'-yl]ethyl]-3-phenylpropanamide;2-[(3'R,3'aS,4aR,6'S,6aR,6bS,7'aR,9R,11aS,11bS)-3',6',10,11b-tetramethyl-3-oxospiro[1,2,4,4a,5,6,6a,6b,7,8,11,11a-dodecahydrobenzo[a]fluorene-9,2'-3,3a,5,6,7,7a-hexahydrofuro[3,2-b]pyridine]-4'-yl]-N-methyl-N-(2-phenylethyl)acetamide;2-[(3'R,3'aS,4aR,6'S,6aR,6bS,7'aR,9R,11aS,11bS)-3',6',10,11b-tetramethyl-3-oxospiro[1,2,4,4a,5,6,6a,6b,7,8,11,11a-dodecahydrobenzo[a]fluorene-9,2'-3,3a,5,6,7,7a-hexahydrofuro[3,2-b]pyridine]-4'-yl]-N-(2-phenylethyl)acetamide;N-[(3S,3'R,3'aS,4aR,6'S,6aR,6bS,7'aR,9R,11aS,11bS)-3',6',10,11b-tetramethylspiro[2,3,4,4a,5,6,6a,6b,7,8,11,11a-dodecahydro-1H-benzo[a]fluorene-9,2'-3a,4,5,6,7,7a-hexahydro-3H-furo[3,2-b]pyridine]-3-yl]methanesulfonamide;N-[(3R,3'R,3'aS,4aR,6'S,6aR,6bS,7'aR,9R,11aS,11bS)-3',6',10,11b-tetramethylspiro[2,3,4,4a,5,6,6a,6b,7,8,11,11a-dodecahydro-1H-benzo[a]fluorene-9,2'-3a,4,5,6,7,7a-hexahydro-3H-furo[3,2-b]pyridine]-3-yl]methanesulfonamide;methane
• PubChem CID: 159886212
• Molecular Formula: C170H256N10O15S2
• Molecular Weight: 2744.11 g/mol
• Exact Mass: 2741.90
• IUPAC Name: N-[2-[(3'R,3'aS,4aR,6'S,6aR,6bS,7'aR,9R,11aS,11bS)-3',6',10,11b-tetramethyl-3-oxospiro[1,2,4,4a,5,6,6a,6b,7,8,11,11a-dodecahydrobenzo[a]fluorene-9,2'-3,3a,5,6,7,7a-hexahydrofuro[3,2-b]pyridine]-4'-yl]ethyl]-3-phenylpropanamide;2-[(3'R,3'aS,4aR,6'S,6aR,6bS,7'aR,9R,11aS,11bS)-3',6',10,11b-tetramethyl-3-oxospiro[1,2,4,4a,5,6,6a,6b,7,8,11,11a-dodecahydrobenzo[a]fluorene-9,2'-3,3a,5,6,7,7a-hexahydrofuro[3,2-b]pyridine]-4'-yl]-N-methyl-N-(2-phenylethyl)acetamide;2-[(3'R,3'aS,4aR,6'S,6aR,6bS,7'aR,9R,11aS,11bS)-3',6',10,11b-tetramethyl-3-oxospiro[1,2,4,4a,5,6,6a,6b,7,8,11,11a-dodecahydrobenzo[a]fluorene-9,2'-3,3a,5,6,7,7a-hexahydrofuro[3,2-b]pyridine]-4'-yl]-N-(2-phenylethyl)acetamide;N-[(3S,3'R,3'aS,4aR,6'S,6aR,6bS,7'aR,9R,11aS,11bS)-3',6',10,11b-tetramethylspiro[2,3,4,4a,5,6,6a,6b,7,8,11,11a-dodecahydro-1H-benzo[a]fluorene-9,2'-3a,4,5,6,7,7a-hexahydro-3H-furo[3,2-b]pyridine]-3-yl]methanesulfonamide;N-[(3R,3'R,3'aS,4aR,6'S,6aR,6bS,7'aR,9R,11aS,11bS)-3',6',10,11b-tetramethylspiro[2,3,4,4a,5,6,6a,6b,7,8,11,11a-dodecahydro-1H-benzo[a]fluorene-9,2'-3a,4,5,6,7,7a-hexahydro-3H-furo[3,2-b]pyridine]-3-yl]methanesulfonamide;methane
• SMILES: C.CC1=C2C[C@H]3[C@@H](CC[C@@H]4CC(=O)CC[C@@]43C)[C@@H]2CC[C@]12O[C@@H]1C[C@H](C)CN(CC(=O)N(C)CCc3ccccc3)[C@H]1[C@H]2C.CC1=C2C[C@H]3[C@@H](CC[C@@H]4CC(=O)CC[C@@]43C)[C@@H]2CC[C@]12O[C@@H]1C[C@H](C)CN(CC(=O)NCCc3ccccc3)[C@H]1[C@H]2C.CC1=C2C[C@H]3[C@@H](CC[C@@H]4CC(=O)CC[C@@]43C)[C@@H]2CC[C@]12O[C@@H]1C[C@H](C)CN(CCNC(=O)CCc3ccccc3)[C@H]1[C@H]2C.CC1=C2C[C@H]3[C@@H](CC[C@@H]4C[C@@H](NS(C)(=O)=O)CC[C@@]43C)[C@@H]2CC[C@]12O[C@@H]1C[C@H](C)CN[C@H]1[C@H]2C.CC1=C2C[C@H]3[C@@H](CC[C@@H]4C[C@H](NS(C)(=O)=O)CC[C@@]43C)[C@@H]2CC[C@]12O[C@@H]1C[C@H](C)CN[C@H]1[C@H]2C
• InChI: InChI=1S/2C38H54N2O3.C37H52N2O3.2C28H46N2O3S.CH4/c1-24-19-34-36(40(22-24)23-35(42)39(5)18-15-27-9-7-6-8-10-27)26(3)38(43-34)17-14-30-31-12-11-28-20-29(41)13-16-37(28,4)33(31)21-32(30)25(38)2;1-24-20-34-36(40(23-24)19-18-39-35(42)13-10-27-8-6-5-7-9-27)26(3)38(43-34)17-15-30-31-12-11-28-21-29(41)14-16-37(28,4)33(31)22-32(30)25(38)2;1-23-18-33-35(39(21-23)22-34(41)38-17-14-26-8-6-5-7-9-26)25(3)37(42-33)16-13-29-30-11-10-27-19-28(40)12-15-36(27,4)32(30)20-31(29)24(37)2;2*1-16-12-25-26(29-15-16)18(3)28(33-25)11-9-21-22-7-6-19-13-20(30-34(5,31)32)8-10-27(19,4)24(22)14-23(21)17(28)2;/h6-10,24,26,28,30-31,33-34,36H,11-23H2,1-5H3;5-9,24,26,28,30-31,33-34,36H,10-23H2,1-4H3,(H,39,42);5-9,23,25,27,29-30,32-33,35H,10-22H2,1-4H3,(H,38,41);2*16,18-22,24-26,29-30H,6-15H2,1-5H3;1H4/t2*24-,26+,28+,30-,31-,33-,34+,36-,37-,38-;23-,25+,27+,29-,30-,32-,33+,35-,36-,37-;16-,18+,19+,20+,21-,22-,24-,25+,26-,27-,28-;16-,18+,19+,20-,21-,22-,24-,25+,26-,27-,28-;/m00000./s1
• InChIKey: NUEBRBLLVOZQKH-ZQPPGHHLSA-N
• XLogP: 29.73
• TPSA: 301.99 Ų
• H-Bond Donors: 6
• H-Bond Acceptors: 20
• Rotatable Bonds: 20
• Heavy Atoms: 197
• Complexity: —

Lipinski Rule of Five

4 violations

Rule	Value
MW ≤ 500	2744.11
LogP ≤ 5	29.73
H-Bond Donors ≤ 5	6
H-Bond Acceptors ≤ 10	20

Frequently Asked Questions

What is the IUPAC name of N-[2-[(3'R,3'aS,4aR,6'S,6aR,6bS,7'aR,9R,11aS,11bS)-3',6',10,11b-tetramethyl-3-oxospiro[1,2,4,4a,5,6,6a,6b,7,8,11,11a-dodecahydrobenzo[a]fluorene-9,2'-3,3a,5,6,7,7a-hexahydrofuro[3,2-b]pyridine]-4'-yl]ethyl]-3-phenylpropanamide;2-[(3'R,3'aS,4aR,6'S,6aR,6bS,7'aR,9R,11aS,11bS)-3',6',10,11b-tetramethyl-3-oxospiro[1,2,4,4a,5,6,6a,6b,7,8,11,11a-dodecahydrobenzo[a]fluorene-9,2'-3,3a,5,6,7,7a-hexahydrofuro[3,2-b]pyridine]-4'-yl]-N-methyl-N-(2-phenylethyl)acetamide;2-[(3'R,3'aS,4aR,6'S,6aR,6bS,7'aR,9R,11aS,11bS)-3',6',10,11b-tetramethyl-3-oxospiro[1,2,4,4a,5,6,6a,6b,7,8,11,11a-dodecahydrobenzo[a]fluorene-9,2'-3,3a,5,6,7,7a-hexahydrofuro[3,2-b]pyridine]-4'-yl]-N-(2-phenylethyl)acetamide;N-[(3S,3'R,3'aS,4aR,6'S,6aR,6bS,7'aR,9R,11aS,11bS)-3',6',10,11b-tetramethylspiro[2,3,4,4a,5,6,6a,6b,7,8,11,11a-dodecahydro-1H-benzo[a]fluorene-9,2'-3a,4,5,6,7,7a-hexahydro-3H-furo[3,2-b]pyridine]-3-yl]methanesulfonamide;N-[(3R,3'R,3'aS,4aR,6'S,6aR,6bS,7'aR,9R,11aS,11bS)-3',6',10,11b-tetramethylspiro[2,3,4,4a,5,6,6a,6b,7,8,11,11a-dodecahydro-1H-benzo[a]fluorene-9,2'-3a,4,5,6,7,7a-hexahydro-3H-furo[3,2-b]pyridine]-3-yl]methanesulfonamide;methane?

The IUPAC name of N-[2-[(3'R,3'aS,4aR,6'S,6aR,6bS,7'aR,9R,11aS,11bS)-3',6',10,11b-tetramethyl-3-oxospiro[1,2,4,4a,5,6,6a,6b,7,8,11,11a-dodecahydrobenzo[a]fluorene-9,2'-3,3a,5,6,7,7a-hexahydrofuro[3,2-b]pyridine]-4'-yl]ethyl]-3-phenylpropanamide;2-[(3'R,3'aS,4aR,6'S,6aR,6bS,7'aR,9R,11aS,11bS)-3',6',10,11b-tetramethyl-3-oxospiro[1,2,4,4a,5,6,6a,6b,7,8,11,11a-dodecahydrobenzo[a]fluorene-9,2'-3,3a,5,6,7,7a-hexahydrofuro[3,2-b]pyridine]-4'-yl]-N-methyl-N-(2-phenylethyl)acetamide;2-[(3'R,3'aS,4aR,6'S,6aR,6bS,7'aR,9R,11aS,11bS)-3',6',10,11b-tetramethyl-3-oxospiro[1,2,4,4a,5,6,6a,6b,7,8,11,11a-dodecahydrobenzo[a]fluorene-9,2'-3,3a,5,6,7,7a-hexahydrofuro[3,2-b]pyridine]-4'-yl]-N-(2-phenylethyl)acetamide;N-[(3S,3'R,3'aS,4aR,6'S,6aR,6bS,7'aR,9R,11aS,11bS)-3',6',10,11b-tetramethylspiro[2,3,4,4a,5,6,6a,6b,7,8,11,11a-dodecahydro-1H-benzo[a]fluorene-9,2'-3a,4,5,6,7,7a-hexahydro-3H-furo[3,2-b]pyridine]-3-yl]methanesulfonamide;N-[(3R,3'R,3'aS,4aR,6'S,6aR,6bS,7'aR,9R,11aS,11bS)-3',6',10,11b-tetramethylspiro[2,3,4,4a,5,6,6a,6b,7,8,11,11a-dodecahydro-1H-benzo[a]fluorene-9,2'-3a,4,5,6,7,7a-hexahydro-3H-furo[3,2-b]pyridine]-3-yl]methanesulfonamide;methane (CID 159886212) is N-[2-[(3'R,3'aS,4aR,6'S,6aR,6bS,7'aR,9R,11aS,11bS)-3',6',10,11b-tetramethyl-3-oxospiro[1,2,4,4a,5,6,6a,6b,7,8,11,11a-dodecahydrobenzo[a]fluorene-9,2'-3,3a,5,6,7,7a-hexahydrofuro[3,2-b]pyridine]-4'-yl]ethyl]-3-phenylpropanamide;2-[(3'R,3'aS,4aR,6'S,6aR,6bS,7'aR,9R,11aS,11bS)-3',6',10,11b-tetramethyl-3-oxospiro[1,2,4,4a,5,6,6a,6b,7,8,11,11a-dodecahydrobenzo[a]fluorene-9,2'-3,3a,5,6,7,7a-hexahydrofuro[3,2-b]pyridine]-4'-yl]-N-methyl-N-(2-phenylethyl)acetamide;2-[(3'R,3'aS,4aR,6'S,6aR,6bS,7'aR,9R,11aS,11bS)-3',6',10,11b-tetramethyl-3-oxospiro[1,2,4,4a,5,6,6a,6b,7,8,11,11a-dodecahydrobenzo[a]fluorene-9,2'-3,3a,5,6,7,7a-hexahydrofuro[3,2-b]pyridine]-4'-yl]-N-(2-phenylethyl)acetamide;N-[(3S,3'R,3'aS,4aR,6'S,6aR,6bS,7'aR,9R,11aS,11bS)-3',6',10,11b-tetramethylspiro[2,3,4,4a,5,6,6a,6b,7,8,11,11a-dodecahydro-1H-benzo[a]fluorene-9,2'-3a,4,5,6,7,7a-hexahydro-3H-furo[3,2-b]pyridine]-3-yl]methanesulfonamide;N-[(3R,3'R,3'aS,4aR,6'S,6aR,6bS,7'aR,9R,11aS,11bS)-3',6',10,11b-tetramethylspiro[2,3,4,4a,5,6,6a,6b,7,8,11,11a-dodecahydro-1H-benzo[a]fluorene-9,2'-3a,4,5,6,7,7a-hexahydro-3H-furo[3,2-b]pyridine]-3-yl]methanesulfonamide;methane.

What is the SMILES notation for N-[2-[(3'R,3'aS,4aR,6'S,6aR,6bS,7'aR,9R,11aS,11bS)-3',6',10,11b-tetramethyl-3-oxospiro[1,2,4,4a,5,6,6a,6b,7,8,11,11a-dodecahydrobenzo[a]fluorene-9,2'-3,3a,5,6,7,7a-hexahydrofuro[3,2-b]pyridine]-4'-yl]ethyl]-3-phenylpropanamide;2-[(3'R,3'aS,4aR,6'S,6aR,6bS,7'aR,9R,11aS,11bS)-3',6',10,11b-tetramethyl-3-oxospiro[1,2,4,4a,5,6,6a,6b,7,8,11,11a-dodecahydrobenzo[a]fluorene-9,2'-3,3a,5,6,7,7a-hexahydrofuro[3,2-b]pyridine]-4'-yl]-N-methyl-N-(2-phenylethyl)acetamide;2-[(3'R,3'aS,4aR,6'S,6aR,6bS,7'aR,9R,11aS,11bS)-3',6',10,11b-tetramethyl-3-oxospiro[1,2,4,4a,5,6,6a,6b,7,8,11,11a-dodecahydrobenzo[a]fluorene-9,2'-3,3a,5,6,7,7a-hexahydrofuro[3,2-b]pyridine]-4'-yl]-N-(2-phenylethyl)acetamide;N-[(3S,3'R,3'aS,4aR,6'S,6aR,6bS,7'aR,9R,11aS,11bS)-3',6',10,11b-tetramethylspiro[2,3,4,4a,5,6,6a,6b,7,8,11,11a-dodecahydro-1H-benzo[a]fluorene-9,2'-3a,4,5,6,7,7a-hexahydro-3H-furo[3,2-b]pyridine]-3-yl]methanesulfonamide;N-[(3R,3'R,3'aS,4aR,6'S,6aR,6bS,7'aR,9R,11aS,11bS)-3',6',10,11b-tetramethylspiro[2,3,4,4a,5,6,6a,6b,7,8,11,11a-dodecahydro-1H-benzo[a]fluorene-9,2'-3a,4,5,6,7,7a-hexahydro-3H-furo[3,2-b]pyridine]-3-yl]methanesulfonamide;methane?

The canonical SMILES for N-[2-[(3'R,3'aS,4aR,6'S,6aR,6bS,7'aR,9R,11aS,11bS)-3',6',10,11b-tetramethyl-3-oxospiro[1,2,4,4a,5,6,6a,6b,7,8,11,11a-dodecahydrobenzo[a]fluorene-9,2'-3,3a,5,6,7,7a-hexahydrofuro[3,2-b]pyridine]-4'-yl]ethyl]-3-phenylpropanamide;2-[(3'R,3'aS,4aR,6'S,6aR,6bS,7'aR,9R,11aS,11bS)-3',6',10,11b-tetramethyl-3-oxospiro[1,2,4,4a,5,6,6a,6b,7,8,11,11a-dodecahydrobenzo[a]fluorene-9,2'-3,3a,5,6,7,7a-hexahydrofuro[3,2-b]pyridine]-4'-yl]-N-methyl-N-(2-phenylethyl)acetamide;2-[(3'R,3'aS,4aR,6'S,6aR,6bS,7'aR,9R,11aS,11bS)-3',6',10,11b-tetramethyl-3-oxospiro[1,2,4,4a,5,6,6a,6b,7,8,11,11a-dodecahydrobenzo[a]fluorene-9,2'-3,3a,5,6,7,7a-hexahydrofuro[3,2-b]pyridine]-4'-yl]-N-(2-phenylethyl)acetamide;N-[(3S,3'R,3'aS,4aR,6'S,6aR,6bS,7'aR,9R,11aS,11bS)-3',6',10,11b-tetramethylspiro[2,3,4,4a,5,6,6a,6b,7,8,11,11a-dodecahydro-1H-benzo[a]fluorene-9,2'-3a,4,5,6,7,7a-hexahydro-3H-furo[3,2-b]pyridine]-3-yl]methanesulfonamide;N-[(3R,3'R,3'aS,4aR,6'S,6aR,6bS,7'aR,9R,11aS,11bS)-3',6',10,11b-tetramethylspiro[2,3,4,4a,5,6,6a,6b,7,8,11,11a-dodecahydro-1H-benzo[a]fluorene-9,2'-3a,4,5,6,7,7a-hexahydro-3H-furo[3,2-b]pyridine]-3-yl]methanesulfonamide;methane is C.CC1=C2C[C@H]3[C@@H](CC[C@@H]4CC(=O)CC[C@@]43C)[C@@H]2CC[C@]12O[C@@H]1C[C@H](C)CN(CC(=O)N(C)CCc3ccccc3)[C@H]1[C@H]2C.CC1=C2C[C@H]3[C@@H](CC[C@@H]4CC(=O)CC[C@@]43C)[C@@H]2CC[C@]12O[C@@H]1C[C@H](C)CN(CC(=O)NCCc3ccccc3)[C@H]1[C@H]2C.CC1=C2C[C@H]3[C@@H](CC[C@@H]4CC(=O)CC[C@@]43C)[C@@H]2CC[C@]12O[C@@H]1C[C@H](C)CN(CCNC(=O)CCc3ccccc3)[C@H]1[C@H]2C.CC1=C2C[C@H]3[C@@H](CC[C@@H]4C[C@@H](NS(C)(=O)=O)CC[C@@]43C)[C@@H]2CC[C@]12O[C@@H]1C[C@H](C)CN[C@H]1[C@H]2C.CC1=C2C[C@H]3[C@@H](CC[C@@H]4C[C@H](NS(C)(=O)=O)CC[C@@]43C)[C@@H]2CC[C@]12O[C@@H]1C[C@H](C)CN[C@H]1[C@H]2C.

What is the InChIKey of N-[2-[(3'R,3'aS,4aR,6'S,6aR,6bS,7'aR,9R,11aS,11bS)-3',6',10,11b-tetramethyl-3-oxospiro[1,2,4,4a,5,6,6a,6b,7,8,11,11a-dodecahydrobenzo[a]fluorene-9,2'-3,3a,5,6,7,7a-hexahydrofuro[3,2-b]pyridine]-4'-yl]ethyl]-3-phenylpropanamide;2-[(3'R,3'aS,4aR,6'S,6aR,6bS,7'aR,9R,11aS,11bS)-3',6',10,11b-tetramethyl-3-oxospiro[1,2,4,4a,5,6,6a,6b,7,8,11,11a-dodecahydrobenzo[a]fluorene-9,2'-3,3a,5,6,7,7a-hexahydrofuro[3,2-b]pyridine]-4'-yl]-N-methyl-N-(2-phenylethyl)acetamide;2-[(3'R,3'aS,4aR,6'S,6aR,6bS,7'aR,9R,11aS,11bS)-3',6',10,11b-tetramethyl-3-oxospiro[1,2,4,4a,5,6,6a,6b,7,8,11,11a-dodecahydrobenzo[a]fluorene-9,2'-3,3a,5,6,7,7a-hexahydrofuro[3,2-b]pyridine]-4'-yl]-N-(2-phenylethyl)acetamide;N-[(3S,3'R,3'aS,4aR,6'S,6aR,6bS,7'aR,9R,11aS,11bS)-3',6',10,11b-tetramethylspiro[2,3,4,4a,5,6,6a,6b,7,8,11,11a-dodecahydro-1H-benzo[a]fluorene-9,2'-3a,4,5,6,7,7a-hexahydro-3H-furo[3,2-b]pyridine]-3-yl]methanesulfonamide;N-[(3R,3'R,3'aS,4aR,6'S,6aR,6bS,7'aR,9R,11aS,11bS)-3',6',10,11b-tetramethylspiro[2,3,4,4a,5,6,6a,6b,7,8,11,11a-dodecahydro-1H-benzo[a]fluorene-9,2'-3a,4,5,6,7,7a-hexahydro-3H-furo[3,2-b]pyridine]-3-yl]methanesulfonamide;methane?

The InChIKey is NUEBRBLLVOZQKH-ZQPPGHHLSA-N. The full InChI is InChI=1S/2C38H54N2O3.C37H52N2O3.2C28H46N2O3S.CH4/c1-24-19-34-36(40(22-24)23-35(42)39(5)18-15-27-9-7-6-8-10-27)26(3)38(43-34)17-14-30-31-12-11-28-20-29(41)13-16-37(28,4)33(31)21-32(30)25(38)2;1-24-20-34-36(40(23-24)19-18-39-35(42)13-10-27-8-6-5-7-9-27)26(3)38(43-34)17-15-30-31-12-11-28-21-29(41)14-16-37(28,4)33(31)22-32(30)25(38)2;1-23-18-33-35(39(21-23)22-34(41)38-17-14-26-8-6-5-7-9-26)25(3)37(42-33)16-13-29-30-11-10-27-19-28(40)12-15-36(27,4)32(30)20-31(29)24(37)2;2*1-16-12-25-26(29-15-16)18(3)28(33-25)11-9-21-22-7-6-19-13-20(30-34(5,31)32)8-10-27(19,4)24(22)14-23(21)17(28)2;/h6-10,24,26,28,30-31,33-34,36H,11-23H2,1-5H3;5-9,24,26,28,30-31,33-34,36H,10-23H2,1-4H3,(H,39,42);5-9,23,25,27,29-30,32-33,35H,10-22H2,1-4H3,(H,38,41);2*16,18-22,24-26,29-30H,6-15H2,1-5H3;1H4/t2*24-,26+,28+,30-,31-,33-,34+,36-,37-,38-;23-,25+,27+,29-,30-,32-,33+,35-,36-,37-;16-,18+,19+,20+,21-,22-,24-,25+,26-,27-,28-;16-,18+,19+,20-,21-,22-,24-,25+,26-,27-,28-;/m00000./s1.

What are the key properties of N-[2-[(3'R,3'aS,4aR,6'S,6aR,6bS,7'aR,9R,11aS,11bS)-3',6',10,11b-tetramethyl-3-oxospiro[1,2,4,4a,5,6,6a,6b,7,8,11,11a-dodecahydrobenzo[a]fluorene-9,2'-3,3a,5,6,7,7a-hexahydrofuro[3,2-b]pyridine]-4'-yl]ethyl]-3-phenylpropanamide;2-[(3'R,3'aS,4aR,6'S,6aR,6bS,7'aR,9R,11aS,11bS)-3',6',10,11b-tetramethyl-3-oxospiro[1,2,4,4a,5,6,6a,6b,7,8,11,11a-dodecahydrobenzo[a]fluorene-9,2'-3,3a,5,6,7,7a-hexahydrofuro[3,2-b]pyridine]-4'-yl]-N-methyl-N-(2-phenylethyl)acetamide;2-[(3'R,3'aS,4aR,6'S,6aR,6bS,7'aR,9R,11aS,11bS)-3',6',10,11b-tetramethyl-3-oxospiro[1,2,4,4a,5,6,6a,6b,7,8,11,11a-dodecahydrobenzo[a]fluorene-9,2'-3,3a,5,6,7,7a-hexahydrofuro[3,2-b]pyridine]-4'-yl]-N-(2-phenylethyl)acetamide;N-[(3S,3'R,3'aS,4aR,6'S,6aR,6bS,7'aR,9R,11aS,11bS)-3',6',10,11b-tetramethylspiro[2,3,4,4a,5,6,6a,6b,7,8,11,11a-dodecahydro-1H-benzo[a]fluorene-9,2'-3a,4,5,6,7,7a-hexahydro-3H-furo[3,2-b]pyridine]-3-yl]methanesulfonamide;N-[(3R,3'R,3'aS,4aR,6'S,6aR,6bS,7'aR,9R,11aS,11bS)-3',6',10,11b-tetramethylspiro[2,3,4,4a,5,6,6a,6b,7,8,11,11a-dodecahydro-1H-benzo[a]fluorene-9,2'-3a,4,5,6,7,7a-hexahydro-3H-furo[3,2-b]pyridine]-3-yl]methanesulfonamide;methane?

N-[2-[(3'R,3'aS,4aR,6'S,6aR,6bS,7'aR,9R,11aS,11bS)-3',6',10,11b-tetramethyl-3-oxospiro[1,2,4,4a,5,6,6a,6b,7,8,11,11a-dodecahydrobenzo[a]fluorene-9,2'-3,3a,5,6,7,7a-hexahydrofuro[3,2-b]pyridine]-4'-yl]ethyl]-3-phenylpropanamide;2-[(3'R,3'aS,4aR,6'S,6aR,6bS,7'aR,9R,11aS,11bS)-3',6',10,11b-tetramethyl-3-oxospiro[1,2,4,4a,5,6,6a,6b,7,8,11,11a-dodecahydrobenzo[a]fluorene-9,2'-3,3a,5,6,7,7a-hexahydrofuro[3,2-b]pyridine]-4'-yl]-N-methyl-N-(2-phenylethyl)acetamide;2-[(3'R,3'aS,4aR,6'S,6aR,6bS,7'aR,9R,11aS,11bS)-3',6',10,11b-tetramethyl-3-oxospiro[1,2,4,4a,5,6,6a,6b,7,8,11,11a-dodecahydrobenzo[a]fluorene-9,2'-3,3a,5,6,7,7a-hexahydrofuro[3,2-b]pyridine]-4'-yl]-N-(2-phenylethyl)acetamide;N-[(3S,3'R,3'aS,4aR,6'S,6aR,6bS,7'aR,9R,11aS,11bS)-3',6',10,11b-tetramethylspiro[2,3,4,4a,5,6,6a,6b,7,8,11,11a-dodecahydro-1H-benzo[a]fluorene-9,2'-3a,4,5,6,7,7a-hexahydro-3H-furo[3,2-b]pyridine]-3-yl]methanesulfonamide;N-[(3R,3'R,3'aS,4aR,6'S,6aR,6bS,7'aR,9R,11aS,11bS)-3',6',10,11b-tetramethylspiro[2,3,4,4a,5,6,6a,6b,7,8,11,11a-dodecahydro-1H-benzo[a]fluorene-9,2'-3a,4,5,6,7,7a-hexahydro-3H-furo[3,2-b]pyridine]-3-yl]methanesulfonamide;methane has a molecular weight of 2744.11 g/mol, XLogP of 29.73, 20 rotatable bonds, 6 hydrogen bond donors, and 20 hydrogen bond acceptors.

Where does this data come from?

All data for N-[2-[(3'R,3'aS,4aR,6'S,6aR,6bS,7'aR,9R,11aS,11bS)-3',6',10,11b-tetramethyl-3-oxospiro[1,2,4,4a,5,6,6a,6b,7,8,11,11a-dodecahydrobenzo[a]fluorene-9,2'-3,3a,5,6,7,7a-hexahydrofuro[3,2-b]pyridine]-4'-yl]ethyl]-3-phenylpropanamide;2-[(3'R,3'aS,4aR,6'S,6aR,6bS,7'aR,9R,11aS,11bS)-3',6',10,11b-tetramethyl-3-oxospiro[1,2,4,4a,5,6,6a,6b,7,8,11,11a-dodecahydrobenzo[a]fluorene-9,2'-3,3a,5,6,7,7a-hexahydrofuro[3,2-b]pyridine]-4'-yl]-N-methyl-N-(2-phenylethyl)acetamide;2-[(3'R,3'aS,4aR,6'S,6aR,6bS,7'aR,9R,11aS,11bS)-3',6',10,11b-tetramethyl-3-oxospiro[1,2,4,4a,5,6,6a,6b,7,8,11,11a-dodecahydrobenzo[a]fluorene-9,2'-3,3a,5,6,7,7a-hexahydrofuro[3,2-b]pyridine]-4'-yl]-N-(2-phenylethyl)acetamide;N-[(3S,3'R,3'aS,4aR,6'S,6aR,6bS,7'aR,9R,11aS,11bS)-3',6',10,11b-tetramethylspiro[2,3,4,4a,5,6,6a,6b,7,8,11,11a-dodecahydro-1H-benzo[a]fluorene-9,2'-3a,4,5,6,7,7a-hexahydro-3H-furo[3,2-b]pyridine]-3-yl]methanesulfonamide;N-[(3R,3'R,3'aS,4aR,6'S,6aR,6bS,7'aR,9R,11aS,11bS)-3',6',10,11b-tetramethylspiro[2,3,4,4a,5,6,6a,6b,7,8,11,11a-dodecahydro-1H-benzo[a]fluorene-9,2'-3a,4,5,6,7,7a-hexahydro-3H-furo[3,2-b]pyridine]-3-yl]methanesulfonamide;methane is sourced from PubChem (CID 159886212), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).