26-methoxy-23,23-dioxo-3,23λ6-dithia-6,8,12,13,16,24,27-heptazahexacyclo[23.3.1.12,5.110,13.118,22.04,9]dotriaconta-1(29),2(32),4,6,8,10(31),11,18(30),19,21,25,27-dodecaen-17-one;13-methoxy-16,16-dioxo-8,16λ6-dithia-1,5,12,15,23-pentazahexacyclo[23.2.2.16,9.110,14.117,21.02,7]dotriaconta-2(7),3,5,9(32),10(31),11,13,17,19,21(30)-decaen-22-one;26-methoxy-23,23-dioxo-23λ6,32-dithia-6,8,16,24,27-pentazahexacyclo[23.3.1.12,5.110,14.118,22.04,9]dotriaconta-1(29),2,4(9),5,7,10,12,14(31),18(30),19,21,25,27-tridecaen-17-one;18-methoxy-15,15-dioxo-15λ6-thia-5,8,16,19,26,28-hexazahexacyclo[20.5.2.22,5.110,14.117,21.025,28]tritriaconta-1(27),2,10(31),11,13,17,19,21(30),22(29),23,25-undecaen-9-one;13-methoxy-16,16-dioxo-16λ6-thia-5,12,15,23-tetrazaheptacyclo[21.5.3.26,9.110,14.117,21.02,7.026,30]pentatriaconta-1(29),2(7),3,5,8,10(33),11,13,17,19,21(32),26(30),27,34-tetradecaen-22-one

C134H113N27O20S8 — CID 158443037

About 26-methoxy-23,23-dioxo-3,23λ6-dithia-6,8,12,13,16,24,27-heptazahexacyclo[23.3.1.12,5.110,13.118,22.04,9]dotriaconta-1(29),2(32),4,6,8,10(31),11,18(30),19,21,25,27-dodecaen-17-one;13-methoxy-16,16-dioxo-8,16λ6-dithia-1,5,12,15,23-pentazahexacyclo[23.2.2.16,9.110,14.117,21.02,7]dotriaconta-2(7),3,5,9(32),10(31),11,13,17,19,21(30)-decaen-22-one;26-methoxy-23,23-dioxo-23λ6,32-dithia-6,8,16,24,27-pentazahexacyclo[23.3.1.12,5.110,14.118,22.04,9]dotriaconta-1(29),2,4(9),5,7,10,12,14(31),18(30),19,21,25,27-tridecaen-17-one;18-methoxy-15,15-dioxo-15λ6-thia-5,8,16,19,26,28-hexazahexacyclo[20.5.2.22,5.110,14.117,21.025,28]tritriaconta-1(27),2,10(31),11,13,17,19,21(30),22(29),23,25-undecaen-9-one;13-methoxy-16,16-dioxo-16λ6-thia-5,12,15,23-tetrazaheptacyclo[21.5.3.26,9.110,14.117,21.02,7.026,30]pentatriaconta-1(29),2(7),3,5,8,10(33),11,13,17,19,21(32),26(30),27,34-tetradecaen-22-one

26-methoxy-23,23-dioxo-3,23λ6-dithia-6,8,12,13,16,24,27-heptazahexacyclo[23.3.1.12,5.110,13.118,22.04,9]dotriaconta-1(29),2(32),4,6,8,10(31),11,18(30),19,21,25,27-dodecaen-17-one;13-methoxy-16,16-dioxo-8,16λ6-dithia-1,5,12,15,23-pentazahexacyclo[23.2.2.16,9.110,14.117,21.02,7]dotriaconta-2(7),3,5,9(32),10(31),11,13,17,19,21(30)-decaen-22-one;26-methoxy-23,23-dioxo-23λ6,32-dithia-6,8,16,24,27-pentazahexacyclo[23.3.1.12,5.110,14.118,22.04,9]dotriaconta-1(29),2,4(9),5,7,10,12,14(31),18(30),19,21,25,27-tridecaen-17-one;18-methoxy-15,15-dioxo-15λ6-thia-5,8,16,19,26,28-hexazahexacyclo[20.5.2.22,5.110,14.117,21.025,28]tritriaconta-1(27),2,10(31),11,13,17,19,21(30),22(29),23,25-undecaen-9-one;13-methoxy-16,16-dioxo-16λ6-thia-5,12,15,23-tetrazaheptacyclo[21.5.3.26,9.110,14.117,21.02,7.026,30]pentatriaconta-1(29),2(7),3,5,8,10(33),11,13,17,19,21(32),26(30),27,34-tetradecaen-22-one (PubChem CID 158443037) has the molecular formula C134H113N27O20S8 and a molecular weight of 2678.08 g/mol. Its IUPAC name is 26-methoxy-23,23-dioxo-3,23λ6-dithia-6,8,12,13,16,24,27-heptazahexacyclo[23.3.1.12,5.110,13.118,22.04,9]dotriaconta-1(29),2(32),4,6,8,10(31),11,18(30),19,21,25,27-dodecaen-17-one;13-methoxy-16,16-dioxo-8,16λ6-dithia-1,5,12,15,23-pentazahexacyclo[23.2.2.16,9.110,14.117,21.02,7]dotriaconta-2(7),3,5,9(32),10(31),11,13,17,19,21(30)-decaen-22-one;26-methoxy-23,23-dioxo-23λ6,32-dithia-6,8,16,24,27-pentazahexacyclo[23.3.1.12,5.110,14.118,22.04,9]dotriaconta-1(29),2,4(9),5,7,10,12,14(31),18(30),19,21,25,27-tridecaen-17-one;18-methoxy-15,15-dioxo-15λ6-thia-5,8,16,19,26,28-hexazahexacyclo[20.5.2.22,5.110,14.117,21.025,28]tritriaconta-1(27),2,10(31),11,13,17,19,21(30),22(29),23,25-undecaen-9-one;13-methoxy-16,16-dioxo-16λ6-thia-5,12,15,23-tetrazaheptacyclo[21.5.3.26,9.110,14.117,21.02,7.026,30]pentatriaconta-1(29),2(7),3,5,8,10(33),11,13,17,19,21(32),26(30),27,34-tetradecaen-22-one.

Molecular Properties

• Compound Name: 26-methoxy-23,23-dioxo-3,23λ6-dithia-6,8,12,13,16,24,27-heptazahexacyclo[23.3.1.12,5.110,13.118,22.04,9]dotriaconta-1(29),2(32),4,6,8,10(31),11,18(30),19,21,25,27-dodecaen-17-one;13-methoxy-16,16-dioxo-8,16λ6-dithia-1,5,12,15,23-pentazahexacyclo[23.2.2.16,9.110,14.117,21.02,7]dotriaconta-2(7),3,5,9(32),10(31),11,13,17,19,21(30)-decaen-22-one;26-methoxy-23,23-dioxo-23λ6,32-dithia-6,8,16,24,27-pentazahexacyclo[23.3.1.12,5.110,14.118,22.04,9]dotriaconta-1(29),2,4(9),5,7,10,12,14(31),18(30),19,21,25,27-tridecaen-17-one;18-methoxy-15,15-dioxo-15λ6-thia-5,8,16,19,26,28-hexazahexacyclo[20.5.2.22,5.110,14.117,21.025,28]tritriaconta-1(27),2,10(31),11,13,17,19,21(30),22(29),23,25-undecaen-9-one;13-methoxy-16,16-dioxo-16λ6-thia-5,12,15,23-tetrazaheptacyclo[21.5.3.26,9.110,14.117,21.02,7.026,30]pentatriaconta-1(29),2(7),3,5,8,10(33),11,13,17,19,21(32),26(30),27,34-tetradecaen-22-one
• PubChem CID: 158443037
• Molecular Formula: C134H113N27O20S8
• Molecular Weight: 2678.08 g/mol
• Exact Mass: 2675.64
• IUPAC Name: 26-methoxy-23,23-dioxo-3,23λ6-dithia-6,8,12,13,16,24,27-heptazahexacyclo[23.3.1.12,5.110,13.118,22.04,9]dotriaconta-1(29),2(32),4,6,8,10(31),11,18(30),19,21,25,27-dodecaen-17-one;13-methoxy-16,16-dioxo-8,16λ6-dithia-1,5,12,15,23-pentazahexacyclo[23.2.2.16,9.110,14.117,21.02,7]dotriaconta-2(7),3,5,9(32),10(31),11,13,17,19,21(30)-decaen-22-one;26-methoxy-23,23-dioxo-23λ6,32-dithia-6,8,16,24,27-pentazahexacyclo[23.3.1.12,5.110,14.118,22.04,9]dotriaconta-1(29),2,4(9),5,7,10,12,14(31),18(30),19,21,25,27-tridecaen-17-one;18-methoxy-15,15-dioxo-15λ6-thia-5,8,16,19,26,28-hexazahexacyclo[20.5.2.22,5.110,14.117,21.025,28]tritriaconta-1(27),2,10(31),11,13,17,19,21(30),22(29),23,25-undecaen-9-one;13-methoxy-16,16-dioxo-16λ6-thia-5,12,15,23-tetrazaheptacyclo[21.5.3.26,9.110,14.117,21.02,7.026,30]pentatriaconta-1(29),2(7),3,5,8,10(33),11,13,17,19,21(32),26(30),27,34-tetradecaen-22-one
• SMILES: COc1ncc2cc1NS(=O)(=O)c1cccc(c1)C(=O)N1CCc3ccc(cc3C1)-c1ccnc3ccc-2cc13.COc1ncc2cc1NS(=O)(=O)c1cccc(c1)C(=O)NCC1CCN(CC1)c1ccnc3cc-2sc13.COc1ncc2cc1NS(=O)(=O)c1cccc(c1)C(=O)NCCN1CC=C(CC1)c1cnc3ccc-2cn13.COc1ncc2cc1NS(=O)(=O)c1cccc(c1)C(=O)NCCn1cc(cn1)-c1ncnc3cc-2sc13.COc1ncc2cc1NS(=O)(=O)c1cccc(c1)C(=O)NCc1cccc(c1)-c1ncnc3sc-2cc13
• InChI: InChI=1S/C31H24N4O4S.C27H26N6O4S.C26H19N5O4S2.C26H25N5O4S2.C24H19N7O4S2/c1-39-30-29-16-23(17-33-30)20-7-8-28-27(15-20)26(9-11-32-28)21-6-5-19-10-12-35(18-24(19)13-21)31(36)22-3-2-4-25(14-22)40(37,38)34-29;1-37-27-23-14-21(15-30-27)20-5-6-25-29-16-24(33(25)17-20)18-7-10-32(11-8-18)12-9-28-26(34)19-3-2-4-22(13-19)38(35,36)31-23;1-35-25-21-10-18(13-28-25)22-11-20-23(29-14-30-26(20)36-22)16-5-2-4-15(8-16)12-27-24(32)17-6-3-7-19(9-17)37(33,34)31-21;1-35-26-21-12-18(15-29-26)23-13-20-24(36-23)22(5-8-27-20)31-9-6-16(7-10-31)14-28-25(32)17-3-2-4-19(11-17)37(33,34)30-21;1-35-24-19-8-15(10-26-24)20-9-18-22(36-20)21(28-13-27-18)16-11-29-31(12-16)6-5-25-23(32)14-3-2-4-17(7-14)37(33,34)30-19/h2-9,11,13-17,34H,10,12,18H2,1H3;2-7,13-17,31H,8-12H2,1H3,(H,28,34);2-11,13-14,31H,12H2,1H3,(H,27,32);2-5,8,11-13,15-16,30H,6-7,9-10,14H2,1H3,(H,28,32);2-4,7-13,30H,5-6H2,1H3,(H,25,32)
• InChIKey: HDAYCSFLCDEDDD-UHFFFAOYSA-N
• XLogP: 20.09
• TPSA: 597.10 Ų
• H-Bond Donors: 9
• H-Bond Acceptors: 40
• Rotatable Bonds: 5
• Heavy Atoms: 189
• Complexity: —

Lipinski Rule of Five

4 violations

Rule	Value
MW ≤ 500	2678.08
LogP ≤ 5	20.09
H-Bond Donors ≤ 5	9
H-Bond Acceptors ≤ 10	40

Frequently Asked Questions

What is the IUPAC name of 26-methoxy-23,23-dioxo-3,23λ6-dithia-6,8,12,13,16,24,27-heptazahexacyclo[23.3.1.12,5.110,13.118,22.04,9]dotriaconta-1(29),2(32),4,6,8,10(31),11,18(30),19,21,25,27-dodecaen-17-one;13-methoxy-16,16-dioxo-8,16λ6-dithia-1,5,12,15,23-pentazahexacyclo[23.2.2.16,9.110,14.117,21.02,7]dotriaconta-2(7),3,5,9(32),10(31),11,13,17,19,21(30)-decaen-22-one;26-methoxy-23,23-dioxo-23λ6,32-dithia-6,8,16,24,27-pentazahexacyclo[23.3.1.12,5.110,14.118,22.04,9]dotriaconta-1(29),2,4(9),5,7,10,12,14(31),18(30),19,21,25,27-tridecaen-17-one;18-methoxy-15,15-dioxo-15λ6-thia-5,8,16,19,26,28-hexazahexacyclo[20.5.2.22,5.110,14.117,21.025,28]tritriaconta-1(27),2,10(31),11,13,17,19,21(30),22(29),23,25-undecaen-9-one;13-methoxy-16,16-dioxo-16λ6-thia-5,12,15,23-tetrazaheptacyclo[21.5.3.26,9.110,14.117,21.02,7.026,30]pentatriaconta-1(29),2(7),3,5,8,10(33),11,13,17,19,21(32),26(30),27,34-tetradecaen-22-one?

The IUPAC name of 26-methoxy-23,23-dioxo-3,23λ6-dithia-6,8,12,13,16,24,27-heptazahexacyclo[23.3.1.12,5.110,13.118,22.04,9]dotriaconta-1(29),2(32),4,6,8,10(31),11,18(30),19,21,25,27-dodecaen-17-one;13-methoxy-16,16-dioxo-8,16λ6-dithia-1,5,12,15,23-pentazahexacyclo[23.2.2.16,9.110,14.117,21.02,7]dotriaconta-2(7),3,5,9(32),10(31),11,13,17,19,21(30)-decaen-22-one;26-methoxy-23,23-dioxo-23λ6,32-dithia-6,8,16,24,27-pentazahexacyclo[23.3.1.12,5.110,14.118,22.04,9]dotriaconta-1(29),2,4(9),5,7,10,12,14(31),18(30),19,21,25,27-tridecaen-17-one;18-methoxy-15,15-dioxo-15λ6-thia-5,8,16,19,26,28-hexazahexacyclo[20.5.2.22,5.110,14.117,21.025,28]tritriaconta-1(27),2,10(31),11,13,17,19,21(30),22(29),23,25-undecaen-9-one;13-methoxy-16,16-dioxo-16λ6-thia-5,12,15,23-tetrazaheptacyclo[21.5.3.26,9.110,14.117,21.02,7.026,30]pentatriaconta-1(29),2(7),3,5,8,10(33),11,13,17,19,21(32),26(30),27,34-tetradecaen-22-one (CID 158443037) is 26-methoxy-23,23-dioxo-3,23λ6-dithia-6,8,12,13,16,24,27-heptazahexacyclo[23.3.1.12,5.110,13.118,22.04,9]dotriaconta-1(29),2(32),4,6,8,10(31),11,18(30),19,21,25,27-dodecaen-17-one;13-methoxy-16,16-dioxo-8,16λ6-dithia-1,5,12,15,23-pentazahexacyclo[23.2.2.16,9.110,14.117,21.02,7]dotriaconta-2(7),3,5,9(32),10(31),11,13,17,19,21(30)-decaen-22-one;26-methoxy-23,23-dioxo-23λ6,32-dithia-6,8,16,24,27-pentazahexacyclo[23.3.1.12,5.110,14.118,22.04,9]dotriaconta-1(29),2,4(9),5,7,10,12,14(31),18(30),19,21,25,27-tridecaen-17-one;18-methoxy-15,15-dioxo-15λ6-thia-5,8,16,19,26,28-hexazahexacyclo[20.5.2.22,5.110,14.117,21.025,28]tritriaconta-1(27),2,10(31),11,13,17,19,21(30),22(29),23,25-undecaen-9-one;13-methoxy-16,16-dioxo-16λ6-thia-5,12,15,23-tetrazaheptacyclo[21.5.3.26,9.110,14.117,21.02,7.026,30]pentatriaconta-1(29),2(7),3,5,8,10(33),11,13,17,19,21(32),26(30),27,34-tetradecaen-22-one.

What is the SMILES notation for 26-methoxy-23,23-dioxo-3,23λ6-dithia-6,8,12,13,16,24,27-heptazahexacyclo[23.3.1.12,5.110,13.118,22.04,9]dotriaconta-1(29),2(32),4,6,8,10(31),11,18(30),19,21,25,27-dodecaen-17-one;13-methoxy-16,16-dioxo-8,16λ6-dithia-1,5,12,15,23-pentazahexacyclo[23.2.2.16,9.110,14.117,21.02,7]dotriaconta-2(7),3,5,9(32),10(31),11,13,17,19,21(30)-decaen-22-one;26-methoxy-23,23-dioxo-23λ6,32-dithia-6,8,16,24,27-pentazahexacyclo[23.3.1.12,5.110,14.118,22.04,9]dotriaconta-1(29),2,4(9),5,7,10,12,14(31),18(30),19,21,25,27-tridecaen-17-one;18-methoxy-15,15-dioxo-15λ6-thia-5,8,16,19,26,28-hexazahexacyclo[20.5.2.22,5.110,14.117,21.025,28]tritriaconta-1(27),2,10(31),11,13,17,19,21(30),22(29),23,25-undecaen-9-one;13-methoxy-16,16-dioxo-16λ6-thia-5,12,15,23-tetrazaheptacyclo[21.5.3.26,9.110,14.117,21.02,7.026,30]pentatriaconta-1(29),2(7),3,5,8,10(33),11,13,17,19,21(32),26(30),27,34-tetradecaen-22-one?

The canonical SMILES for 26-methoxy-23,23-dioxo-3,23λ6-dithia-6,8,12,13,16,24,27-heptazahexacyclo[23.3.1.12,5.110,13.118,22.04,9]dotriaconta-1(29),2(32),4,6,8,10(31),11,18(30),19,21,25,27-dodecaen-17-one;13-methoxy-16,16-dioxo-8,16λ6-dithia-1,5,12,15,23-pentazahexacyclo[23.2.2.16,9.110,14.117,21.02,7]dotriaconta-2(7),3,5,9(32),10(31),11,13,17,19,21(30)-decaen-22-one;26-methoxy-23,23-dioxo-23λ6,32-dithia-6,8,16,24,27-pentazahexacyclo[23.3.1.12,5.110,14.118,22.04,9]dotriaconta-1(29),2,4(9),5,7,10,12,14(31),18(30),19,21,25,27-tridecaen-17-one;18-methoxy-15,15-dioxo-15λ6-thia-5,8,16,19,26,28-hexazahexacyclo[20.5.2.22,5.110,14.117,21.025,28]tritriaconta-1(27),2,10(31),11,13,17,19,21(30),22(29),23,25-undecaen-9-one;13-methoxy-16,16-dioxo-16λ6-thia-5,12,15,23-tetrazaheptacyclo[21.5.3.26,9.110,14.117,21.02,7.026,30]pentatriaconta-1(29),2(7),3,5,8,10(33),11,13,17,19,21(32),26(30),27,34-tetradecaen-22-one is COc1ncc2cc1NS(=O)(=O)c1cccc(c1)C(=O)N1CCc3ccc(cc3C1)-c1ccnc3ccc-2cc13.COc1ncc2cc1NS(=O)(=O)c1cccc(c1)C(=O)NCC1CCN(CC1)c1ccnc3cc-2sc13.COc1ncc2cc1NS(=O)(=O)c1cccc(c1)C(=O)NCCN1CC=C(CC1)c1cnc3ccc-2cn13.COc1ncc2cc1NS(=O)(=O)c1cccc(c1)C(=O)NCCn1cc(cn1)-c1ncnc3cc-2sc13.COc1ncc2cc1NS(=O)(=O)c1cccc(c1)C(=O)NCc1cccc(c1)-c1ncnc3sc-2cc13.

What is the InChIKey of 26-methoxy-23,23-dioxo-3,23λ6-dithia-6,8,12,13,16,24,27-heptazahexacyclo[23.3.1.12,5.110,13.118,22.04,9]dotriaconta-1(29),2(32),4,6,8,10(31),11,18(30),19,21,25,27-dodecaen-17-one;13-methoxy-16,16-dioxo-8,16λ6-dithia-1,5,12,15,23-pentazahexacyclo[23.2.2.16,9.110,14.117,21.02,7]dotriaconta-2(7),3,5,9(32),10(31),11,13,17,19,21(30)-decaen-22-one;26-methoxy-23,23-dioxo-23λ6,32-dithia-6,8,16,24,27-pentazahexacyclo[23.3.1.12,5.110,14.118,22.04,9]dotriaconta-1(29),2,4(9),5,7,10,12,14(31),18(30),19,21,25,27-tridecaen-17-one;18-methoxy-15,15-dioxo-15λ6-thia-5,8,16,19,26,28-hexazahexacyclo[20.5.2.22,5.110,14.117,21.025,28]tritriaconta-1(27),2,10(31),11,13,17,19,21(30),22(29),23,25-undecaen-9-one;13-methoxy-16,16-dioxo-16λ6-thia-5,12,15,23-tetrazaheptacyclo[21.5.3.26,9.110,14.117,21.02,7.026,30]pentatriaconta-1(29),2(7),3,5,8,10(33),11,13,17,19,21(32),26(30),27,34-tetradecaen-22-one?

The InChIKey is HDAYCSFLCDEDDD-UHFFFAOYSA-N. The full InChI is InChI=1S/C31H24N4O4S.C27H26N6O4S.C26H19N5O4S2.C26H25N5O4S2.C24H19N7O4S2/c1-39-30-29-16-23(17-33-30)20-7-8-28-27(15-20)26(9-11-32-28)21-6-5-19-10-12-35(18-24(19)13-21)31(36)22-3-2-4-25(14-22)40(37,38)34-29;1-37-27-23-14-21(15-30-27)20-5-6-25-29-16-24(33(25)17-20)18-7-10-32(11-8-18)12-9-28-26(34)19-3-2-4-22(13-19)38(35,36)31-23;1-35-25-21-10-18(13-28-25)22-11-20-23(29-14-30-26(20)36-22)16-5-2-4-15(8-16)12-27-24(32)17-6-3-7-19(9-17)37(33,34)31-21;1-35-26-21-12-18(15-29-26)23-13-20-24(36-23)22(5-8-27-20)31-9-6-16(7-10-31)14-28-25(32)17-3-2-4-19(11-17)37(33,34)30-21;1-35-24-19-8-15(10-26-24)20-9-18-22(36-20)21(28-13-27-18)16-11-29-31(12-16)6-5-25-23(32)14-3-2-4-17(7-14)37(33,34)30-19/h2-9,11,13-17,34H,10,12,18H2,1H3;2-7,13-17,31H,8-12H2,1H3,(H,28,34);2-11,13-14,31H,12H2,1H3,(H,27,32);2-5,8,11-13,15-16,30H,6-7,9-10,14H2,1H3,(H,28,32);2-4,7-13,30H,5-6H2,1H3,(H,25,32).

What are the key properties of 26-methoxy-23,23-dioxo-3,23λ6-dithia-6,8,12,13,16,24,27-heptazahexacyclo[23.3.1.12,5.110,13.118,22.04,9]dotriaconta-1(29),2(32),4,6,8,10(31),11,18(30),19,21,25,27-dodecaen-17-one;13-methoxy-16,16-dioxo-8,16λ6-dithia-1,5,12,15,23-pentazahexacyclo[23.2.2.16,9.110,14.117,21.02,7]dotriaconta-2(7),3,5,9(32),10(31),11,13,17,19,21(30)-decaen-22-one;26-methoxy-23,23-dioxo-23λ6,32-dithia-6,8,16,24,27-pentazahexacyclo[23.3.1.12,5.110,14.118,22.04,9]dotriaconta-1(29),2,4(9),5,7,10,12,14(31),18(30),19,21,25,27-tridecaen-17-one;18-methoxy-15,15-dioxo-15λ6-thia-5,8,16,19,26,28-hexazahexacyclo[20.5.2.22,5.110,14.117,21.025,28]tritriaconta-1(27),2,10(31),11,13,17,19,21(30),22(29),23,25-undecaen-9-one;13-methoxy-16,16-dioxo-16λ6-thia-5,12,15,23-tetrazaheptacyclo[21.5.3.26,9.110,14.117,21.02,7.026,30]pentatriaconta-1(29),2(7),3,5,8,10(33),11,13,17,19,21(32),26(30),27,34-tetradecaen-22-one?

26-methoxy-23,23-dioxo-3,23λ6-dithia-6,8,12,13,16,24,27-heptazahexacyclo[23.3.1.12,5.110,13.118,22.04,9]dotriaconta-1(29),2(32),4,6,8,10(31),11,18(30),19,21,25,27-dodecaen-17-one;13-methoxy-16,16-dioxo-8,16λ6-dithia-1,5,12,15,23-pentazahexacyclo[23.2.2.16,9.110,14.117,21.02,7]dotriaconta-2(7),3,5,9(32),10(31),11,13,17,19,21(30)-decaen-22-one;26-methoxy-23,23-dioxo-23λ6,32-dithia-6,8,16,24,27-pentazahexacyclo[23.3.1.12,5.110,14.118,22.04,9]dotriaconta-1(29),2,4(9),5,7,10,12,14(31),18(30),19,21,25,27-tridecaen-17-one;18-methoxy-15,15-dioxo-15λ6-thia-5,8,16,19,26,28-hexazahexacyclo[20.5.2.22,5.110,14.117,21.025,28]tritriaconta-1(27),2,10(31),11,13,17,19,21(30),22(29),23,25-undecaen-9-one;13-methoxy-16,16-dioxo-16λ6-thia-5,12,15,23-tetrazaheptacyclo[21.5.3.26,9.110,14.117,21.02,7.026,30]pentatriaconta-1(29),2(7),3,5,8,10(33),11,13,17,19,21(32),26(30),27,34-tetradecaen-22-one has a molecular weight of 2678.08 g/mol, XLogP of 20.09, 5 rotatable bonds, 9 hydrogen bond donors, and 40 hydrogen bond acceptors.

Where does this data come from?

All data for 26-methoxy-23,23-dioxo-3,23λ6-dithia-6,8,12,13,16,24,27-heptazahexacyclo[23.3.1.12,5.110,13.118,22.04,9]dotriaconta-1(29),2(32),4,6,8,10(31),11,18(30),19,21,25,27-dodecaen-17-one;13-methoxy-16,16-dioxo-8,16λ6-dithia-1,5,12,15,23-pentazahexacyclo[23.2.2.16,9.110,14.117,21.02,7]dotriaconta-2(7),3,5,9(32),10(31),11,13,17,19,21(30)-decaen-22-one;26-methoxy-23,23-dioxo-23λ6,32-dithia-6,8,16,24,27-pentazahexacyclo[23.3.1.12,5.110,14.118,22.04,9]dotriaconta-1(29),2,4(9),5,7,10,12,14(31),18(30),19,21,25,27-tridecaen-17-one;18-methoxy-15,15-dioxo-15λ6-thia-5,8,16,19,26,28-hexazahexacyclo[20.5.2.22,5.110,14.117,21.025,28]tritriaconta-1(27),2,10(31),11,13,17,19,21(30),22(29),23,25-undecaen-9-one;13-methoxy-16,16-dioxo-16λ6-thia-5,12,15,23-tetrazaheptacyclo[21.5.3.26,9.110,14.117,21.02,7.026,30]pentatriaconta-1(29),2(7),3,5,8,10(33),11,13,17,19,21(32),26(30),27,34-tetradecaen-22-one is sourced from PubChem (CID 158443037), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).