(8S,11R,14S)-14-[[(2R)-6-amino-2-[2-[4-(4-chlorophenyl)phenyl]-2-oxoethyl]hexanoyl]-methylamino]-3,18-dihydroxy-11-methyl-10,13-dioxo-9-azatricyclo[13.3.1.12,6]icosa-1(18),2,4,6(20),15(19),16-hexaene-8-carboxylic acid;4-(4-chlorophenyl)benzoic acid;methane;methyl (8S,11R,14S)-14-[[(2S)-2-amino-6-[(2-methylpropan-2-yl)oxycarbonylamino]hexanoyl]-methylamino]-3,18-dimethoxy-11-methyl-10,13-dioxo-9-azatricyclo[13.3.1.12,6]icosa-1(18),2,4,6(20),15(19),16-hexaene-8-carboxylate;methyl (8S,11R,14S)-14-[[(2R)-2-[2-[4-(4-chlorophenyl)phenyl]-2-oxoethyl]-6-[(2-methylpropan-2-yl)oxycarbonylamino]hexanoyl]-methylamino]-3,18-dimethoxy-11-methyl-10,13-dioxo-9-azatricyclo[13.3.1.12,6]icosa-1(18),2,4,6(20),15(19),16-hexaene-8-carboxylate;molecular hydrogen

C142H169Cl3N10O29 — CID 157151278

About (8S,11R,14S)-14-[[(2R)-6-amino-2-[2-[4-(4-chlorophenyl)phenyl]-2-oxoethyl]hexanoyl]-methylamino]-3,18-dihydroxy-11-methyl-10,13-dioxo-9-azatricyclo[13.3.1.12,6]icosa-1(18),2,4,6(20),15(19),16-hexaene-8-carboxylic acid;4-(4-chlorophenyl)benzoic acid;methane;methyl (8S,11R,14S)-14-[[(2S)-2-amino-6-[(2-methylpropan-2-yl)oxycarbonylamino]hexanoyl]-methylamino]-3,18-dimethoxy-11-methyl-10,13-dioxo-9-azatricyclo[13.3.1.12,6]icosa-1(18),2,4,6(20),15(19),16-hexaene-8-carboxylate;methyl (8S,11R,14S)-14-[[(2R)-2-[2-[4-(4-chlorophenyl)phenyl]-2-oxoethyl]-6-[(2-methylpropan-2-yl)oxycarbonylamino]hexanoyl]-methylamino]-3,18-dimethoxy-11-methyl-10,13-dioxo-9-azatricyclo[13.3.1.12,6]icosa-1(18),2,4,6(20),15(19),16-hexaene-8-carboxylate;molecular hydrogen

(8S,11R,14S)-14-[[(2R)-6-amino-2-[2-[4-(4-chlorophenyl)phenyl]-2-oxoethyl]hexanoyl]-methylamino]-3,18-dihydroxy-11-methyl-10,13-dioxo-9-azatricyclo[13.3.1.12,6]icosa-1(18),2,4,6(20),15(19),16-hexaene-8-carboxylic acid;4-(4-chlorophenyl)benzoic acid;methane;methyl (8S,11R,14S)-14-[[(2S)-2-amino-6-[(2-methylpropan-2-yl)oxycarbonylamino]hexanoyl]-methylamino]-3,18-dimethoxy-11-methyl-10,13-dioxo-9-azatricyclo[13.3.1.12,6]icosa-1(18),2,4,6(20),15(19),16-hexaene-8-carboxylate;methyl (8S,11R,14S)-14-[[(2R)-2-[2-[4-(4-chlorophenyl)phenyl]-2-oxoethyl]-6-[(2-methylpropan-2-yl)oxycarbonylamino]hexanoyl]-methylamino]-3,18-dimethoxy-11-methyl-10,13-dioxo-9-azatricyclo[13.3.1.12,6]icosa-1(18),2,4,6(20),15(19),16-hexaene-8-carboxylate;molecular hydrogen (PubChem CID 157151278) has the molecular formula C142H169Cl3N10O29 and a molecular weight of 2586.31 g/mol. Its IUPAC name is (8S,11R,14S)-14-[[(2R)-6-amino-2-[2-[4-(4-chlorophenyl)phenyl]-2-oxoethyl]hexanoyl]-methylamino]-3,18-dihydroxy-11-methyl-10,13-dioxo-9-azatricyclo[13.3.1.12,6]icosa-1(18),2,4,6(20),15(19),16-hexaene-8-carboxylic acid;4-(4-chlorophenyl)benzoic acid;methane;methyl (8S,11R,14S)-14-[[(2S)-2-amino-6-[(2-methylpropan-2-yl)oxycarbonylamino]hexanoyl]-methylamino]-3,18-dimethoxy-11-methyl-10,13-dioxo-9-azatricyclo[13.3.1.12,6]icosa-1(18),2,4,6(20),15(19),16-hexaene-8-carboxylate;methyl (8S,11R,14S)-14-[[(2R)-2-[2-[4-(4-chlorophenyl)phenyl]-2-oxoethyl]-6-[(2-methylpropan-2-yl)oxycarbonylamino]hexanoyl]-methylamino]-3,18-dimethoxy-11-methyl-10,13-dioxo-9-azatricyclo[13.3.1.12,6]icosa-1(18),2,4,6(20),15(19),16-hexaene-8-carboxylate;molecular hydrogen.

Molecular Properties

• Compound Name: (8S,11R,14S)-14-[[(2R)-6-amino-2-[2-[4-(4-chlorophenyl)phenyl]-2-oxoethyl]hexanoyl]-methylamino]-3,18-dihydroxy-11-methyl-10,13-dioxo-9-azatricyclo[13.3.1.12,6]icosa-1(18),2,4,6(20),15(19),16-hexaene-8-carboxylic acid;4-(4-chlorophenyl)benzoic acid;methane;methyl (8S,11R,14S)-14-[[(2S)-2-amino-6-[(2-methylpropan-2-yl)oxycarbonylamino]hexanoyl]-methylamino]-3,18-dimethoxy-11-methyl-10,13-dioxo-9-azatricyclo[13.3.1.12,6]icosa-1(18),2,4,6(20),15(19),16-hexaene-8-carboxylate;methyl (8S,11R,14S)-14-[[(2R)-2-[2-[4-(4-chlorophenyl)phenyl]-2-oxoethyl]-6-[(2-methylpropan-2-yl)oxycarbonylamino]hexanoyl]-methylamino]-3,18-dimethoxy-11-methyl-10,13-dioxo-9-azatricyclo[13.3.1.12,6]icosa-1(18),2,4,6(20),15(19),16-hexaene-8-carboxylate;molecular hydrogen
• PubChem CID: 157151278
• Molecular Formula: C142H169Cl3N10O29
• Molecular Weight: 2586.31 g/mol
• Exact Mass: 2583.11
• IUPAC Name: (8S,11R,14S)-14-[[(2R)-6-amino-2-[2-[4-(4-chlorophenyl)phenyl]-2-oxoethyl]hexanoyl]-methylamino]-3,18-dihydroxy-11-methyl-10,13-dioxo-9-azatricyclo[13.3.1.12,6]icosa-1(18),2,4,6(20),15(19),16-hexaene-8-carboxylic acid;4-(4-chlorophenyl)benzoic acid;methane;methyl (8S,11R,14S)-14-[[(2S)-2-amino-6-[(2-methylpropan-2-yl)oxycarbonylamino]hexanoyl]-methylamino]-3,18-dimethoxy-11-methyl-10,13-dioxo-9-azatricyclo[13.3.1.12,6]icosa-1(18),2,4,6(20),15(19),16-hexaene-8-carboxylate;methyl (8S,11R,14S)-14-[[(2R)-2-[2-[4-(4-chlorophenyl)phenyl]-2-oxoethyl]-6-[(2-methylpropan-2-yl)oxycarbonylamino]hexanoyl]-methylamino]-3,18-dimethoxy-11-methyl-10,13-dioxo-9-azatricyclo[13.3.1.12,6]icosa-1(18),2,4,6(20),15(19),16-hexaene-8-carboxylate;molecular hydrogen
• SMILES: C.COC(=O)[C@@H]1Cc2ccc(OC)c(c2)-c2cc(ccc2OC)[C@H](N(C)C(=O)[C@@H](N)CCCCNC(=O)OC(C)(C)C)C(=O)C[C@@H](C)C(=O)N1.COC(=O)[C@@H]1Cc2ccc(OC)c(c2)-c2cc(ccc2OC)[C@H](N(C)C(=O)[C@H](CCCCNC(=O)OC(C)(C)C)CC(=O)c2ccc(-c3ccc(Cl)cc3)cc2)C(=O)C[C@@H](C)C(=O)N1.C[C@@H]1CC(=O)[C@@H](N(C)C(=O)[C@H](CCCCN)CC(=O)c2ccc(-c3ccc(Cl)cc3)cc2)c2ccc(O)c(c2)-c2cc(ccc2O)C[C@@H](C(=O)O)NC1=O.O=C(O)c1ccc(-c2ccc(Cl)cc2)cc1.[H][H].[H][H]
• InChI: InChI=1S/C50H58ClN3O10.C42H44ClN3O8.C36H50N4O9.C13H9ClO2.CH4.2H2/c1-30-25-42(56)45(35-19-23-44(62-7)39(28-35)38-26-31(12-22-43(38)61-6)27-40(48(59)63-8)53-46(30)57)54(5)47(58)36(11-9-10-24-52-49(60)64-50(2,3)4)29-41(55)34-15-13-32(14-16-34)33-17-20-37(51)21-18-33;1-24-19-38(50)39(29-13-17-36(48)33(22-29)32-20-25(6-16-35(32)47)21-34(42(53)54)45-40(24)51)46(2)41(52)30(5-3-4-18-44)23-37(49)28-9-7-26(8-10-28)27-11-14-31(43)15-12-27;1-21-17-28(41)31(40(5)33(43)26(37)11-9-10-16-38-35(45)49-36(2,3)4)23-13-15-30(47-7)25(20-23)24-18-22(12-14-29(24)46-6)19-27(34(44)48-8)39-32(21)42;14-12-7-5-10(6-8-12)9-1-3-11(4-2-9)13(15)16;;;/h12-23,26,28,30,36,40,45H,9-11,24-25,27,29H2,1-8H3,(H,52,60)(H,53,57);6-17,20,22,24,30,34,39,47-48H,3-5,18-19,21,23,44H2,1-2H3,(H,45,51)(H,53,54);12-15,18,20-21,26-27,31H,9-11,16-17,19,37H2,1-8H3,(H,38,45)(H,39,42);1-8H,(H,15,16);1H4;2*1H/t30-,36-,40+,45+;24-,30-,34+,39+;21-,26+,27+,31+;;;;/m111..../s1
• InChIKey: ALGXSUNCHUJNGH-OPPWSLQESA-N
• XLogP: 23.44
• TPSA: 566.86 Ų
• H-Bond Donors: 11
• H-Bond Acceptors: 29
• Rotatable Bonds: 37
• Heavy Atoms: 184
• Complexity: —

Lipinski Rule of Five

4 violations

Rule	Value
MW ≤ 500	2586.31
LogP ≤ 5	23.44
H-Bond Donors ≤ 5	11
H-Bond Acceptors ≤ 10	29

Computed Properties (RDKit)

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

Frequently Asked Questions

What is the IUPAC name of (8S,11R,14S)-14-[[(2R)-6-amino-2-[2-[4-(4-chlorophenyl)phenyl]-2-oxoethyl]hexanoyl]-methylamino]-3,18-dihydroxy-11-methyl-10,13-dioxo-9-azatricyclo[13.3.1.12,6]icosa-1(18),2,4,6(20),15(19),16-hexaene-8-carboxylic acid;4-(4-chlorophenyl)benzoic acid;methane;methyl (8S,11R,14S)-14-[[(2S)-2-amino-6-[(2-methylpropan-2-yl)oxycarbonylamino]hexanoyl]-methylamino]-3,18-dimethoxy-11-methyl-10,13-dioxo-9-azatricyclo[13.3.1.12,6]icosa-1(18),2,4,6(20),15(19),16-hexaene-8-carboxylate;methyl (8S,11R,14S)-14-[[(2R)-2-[2-[4-(4-chlorophenyl)phenyl]-2-oxoethyl]-6-[(2-methylpropan-2-yl)oxycarbonylamino]hexanoyl]-methylamino]-3,18-dimethoxy-11-methyl-10,13-dioxo-9-azatricyclo[13.3.1.12,6]icosa-1(18),2,4,6(20),15(19),16-hexaene-8-carboxylate;molecular hydrogen?

The IUPAC name of (8S,11R,14S)-14-[[(2R)-6-amino-2-[2-[4-(4-chlorophenyl)phenyl]-2-oxoethyl]hexanoyl]-methylamino]-3,18-dihydroxy-11-methyl-10,13-dioxo-9-azatricyclo[13.3.1.12,6]icosa-1(18),2,4,6(20),15(19),16-hexaene-8-carboxylic acid;4-(4-chlorophenyl)benzoic acid;methane;methyl (8S,11R,14S)-14-[[(2S)-2-amino-6-[(2-methylpropan-2-yl)oxycarbonylamino]hexanoyl]-methylamino]-3,18-dimethoxy-11-methyl-10,13-dioxo-9-azatricyclo[13.3.1.12,6]icosa-1(18),2,4,6(20),15(19),16-hexaene-8-carboxylate;methyl (8S,11R,14S)-14-[[(2R)-2-[2-[4-(4-chlorophenyl)phenyl]-2-oxoethyl]-6-[(2-methylpropan-2-yl)oxycarbonylamino]hexanoyl]-methylamino]-3,18-dimethoxy-11-methyl-10,13-dioxo-9-azatricyclo[13.3.1.12,6]icosa-1(18),2,4,6(20),15(19),16-hexaene-8-carboxylate;molecular hydrogen (CID 157151278) is (8S,11R,14S)-14-[[(2R)-6-amino-2-[2-[4-(4-chlorophenyl)phenyl]-2-oxoethyl]hexanoyl]-methylamino]-3,18-dihydroxy-11-methyl-10,13-dioxo-9-azatricyclo[13.3.1.12,6]icosa-1(18),2,4,6(20),15(19),16-hexaene-8-carboxylic acid;4-(4-chlorophenyl)benzoic acid;methane;methyl (8S,11R,14S)-14-[[(2S)-2-amino-6-[(2-methylpropan-2-yl)oxycarbonylamino]hexanoyl]-methylamino]-3,18-dimethoxy-11-methyl-10,13-dioxo-9-azatricyclo[13.3.1.12,6]icosa-1(18),2,4,6(20),15(19),16-hexaene-8-carboxylate;methyl (8S,11R,14S)-14-[[(2R)-2-[2-[4-(4-chlorophenyl)phenyl]-2-oxoethyl]-6-[(2-methylpropan-2-yl)oxycarbonylamino]hexanoyl]-methylamino]-3,18-dimethoxy-11-methyl-10,13-dioxo-9-azatricyclo[13.3.1.12,6]icosa-1(18),2,4,6(20),15(19),16-hexaene-8-carboxylate;molecular hydrogen.

What is the SMILES notation for (8S,11R,14S)-14-[[(2R)-6-amino-2-[2-[4-(4-chlorophenyl)phenyl]-2-oxoethyl]hexanoyl]-methylamino]-3,18-dihydroxy-11-methyl-10,13-dioxo-9-azatricyclo[13.3.1.12,6]icosa-1(18),2,4,6(20),15(19),16-hexaene-8-carboxylic acid;4-(4-chlorophenyl)benzoic acid;methane;methyl (8S,11R,14S)-14-[[(2S)-2-amino-6-[(2-methylpropan-2-yl)oxycarbonylamino]hexanoyl]-methylamino]-3,18-dimethoxy-11-methyl-10,13-dioxo-9-azatricyclo[13.3.1.12,6]icosa-1(18),2,4,6(20),15(19),16-hexaene-8-carboxylate;methyl (8S,11R,14S)-14-[[(2R)-2-[2-[4-(4-chlorophenyl)phenyl]-2-oxoethyl]-6-[(2-methylpropan-2-yl)oxycarbonylamino]hexanoyl]-methylamino]-3,18-dimethoxy-11-methyl-10,13-dioxo-9-azatricyclo[13.3.1.12,6]icosa-1(18),2,4,6(20),15(19),16-hexaene-8-carboxylate;molecular hydrogen?

The canonical SMILES for (8S,11R,14S)-14-[[(2R)-6-amino-2-[2-[4-(4-chlorophenyl)phenyl]-2-oxoethyl]hexanoyl]-methylamino]-3,18-dihydroxy-11-methyl-10,13-dioxo-9-azatricyclo[13.3.1.12,6]icosa-1(18),2,4,6(20),15(19),16-hexaene-8-carboxylic acid;4-(4-chlorophenyl)benzoic acid;methane;methyl (8S,11R,14S)-14-[[(2S)-2-amino-6-[(2-methylpropan-2-yl)oxycarbonylamino]hexanoyl]-methylamino]-3,18-dimethoxy-11-methyl-10,13-dioxo-9-azatricyclo[13.3.1.12,6]icosa-1(18),2,4,6(20),15(19),16-hexaene-8-carboxylate;methyl (8S,11R,14S)-14-[[(2R)-2-[2-[4-(4-chlorophenyl)phenyl]-2-oxoethyl]-6-[(2-methylpropan-2-yl)oxycarbonylamino]hexanoyl]-methylamino]-3,18-dimethoxy-11-methyl-10,13-dioxo-9-azatricyclo[13.3.1.12,6]icosa-1(18),2,4,6(20),15(19),16-hexaene-8-carboxylate;molecular hydrogen is C.COC(=O)[C@@H]1Cc2ccc(OC)c(c2)-c2cc(ccc2OC)[C@H](N(C)C(=O)[C@@H](N)CCCCNC(=O)OC(C)(C)C)C(=O)C[C@@H](C)C(=O)N1.COC(=O)[C@@H]1Cc2ccc(OC)c(c2)-c2cc(ccc2OC)[C@H](N(C)C(=O)[C@H](CCCCNC(=O)OC(C)(C)C)CC(=O)c2ccc(-c3ccc(Cl)cc3)cc2)C(=O)C[C@@H](C)C(=O)N1.C[C@@H]1CC(=O)[C@@H](N(C)C(=O)[C@H](CCCCN)CC(=O)c2ccc(-c3ccc(Cl)cc3)cc2)c2ccc(O)c(c2)-c2cc(ccc2O)C[C@@H](C(=O)O)NC1=O.O=C(O)c1ccc(-c2ccc(Cl)cc2)cc1.[H][H].[H][H].

What is the InChIKey of (8S,11R,14S)-14-[[(2R)-6-amino-2-[2-[4-(4-chlorophenyl)phenyl]-2-oxoethyl]hexanoyl]-methylamino]-3,18-dihydroxy-11-methyl-10,13-dioxo-9-azatricyclo[13.3.1.12,6]icosa-1(18),2,4,6(20),15(19),16-hexaene-8-carboxylic acid;4-(4-chlorophenyl)benzoic acid;methane;methyl (8S,11R,14S)-14-[[(2S)-2-amino-6-[(2-methylpropan-2-yl)oxycarbonylamino]hexanoyl]-methylamino]-3,18-dimethoxy-11-methyl-10,13-dioxo-9-azatricyclo[13.3.1.12,6]icosa-1(18),2,4,6(20),15(19),16-hexaene-8-carboxylate;methyl (8S,11R,14S)-14-[[(2R)-2-[2-[4-(4-chlorophenyl)phenyl]-2-oxoethyl]-6-[(2-methylpropan-2-yl)oxycarbonylamino]hexanoyl]-methylamino]-3,18-dimethoxy-11-methyl-10,13-dioxo-9-azatricyclo[13.3.1.12,6]icosa-1(18),2,4,6(20),15(19),16-hexaene-8-carboxylate;molecular hydrogen?

The InChIKey is ALGXSUNCHUJNGH-OPPWSLQESA-N. The full InChI is InChI=1S/C50H58ClN3O10.C42H44ClN3O8.C36H50N4O9.C13H9ClO2.CH4.2H2/c1-30-25-42(56)45(35-19-23-44(62-7)39(28-35)38-26-31(12-22-43(38)61-6)27-40(48(59)63-8)53-46(30)57)54(5)47(58)36(11-9-10-24-52-49(60)64-50(2,3)4)29-41(55)34-15-13-32(14-16-34)33-17-20-37(51)21-18-33;1-24-19-38(50)39(29-13-17-36(48)33(22-29)32-20-25(6-16-35(32)47)21-34(42(53)54)45-40(24)51)46(2)41(52)30(5-3-4-18-44)23-37(49)28-9-7-26(8-10-28)27-11-14-31(43)15-12-27;1-21-17-28(41)31(40(5)33(43)26(37)11-9-10-16-38-35(45)49-36(2,3)4)23-13-15-30(47-7)25(20-23)24-18-22(12-14-29(24)46-6)19-27(34(44)48-8)39-32(21)42;14-12-7-5-10(6-8-12)9-1-3-11(4-2-9)13(15)16;;;/h12-23,26,28,30,36,40,45H,9-11,24-25,27,29H2,1-8H3,(H,52,60)(H,53,57);6-17,20,22,24,30,34,39,47-48H,3-5,18-19,21,23,44H2,1-2H3,(H,45,51)(H,53,54);12-15,18,20-21,26-27,31H,9-11,16-17,19,37H2,1-8H3,(H,38,45)(H,39,42);1-8H,(H,15,16);1H4;2*1H/t30-,36-,40+,45+;24-,30-,34+,39+;21-,26+,27+,31+;;;;/m111..../s1.

What are the key properties of (8S,11R,14S)-14-[[(2R)-6-amino-2-[2-[4-(4-chlorophenyl)phenyl]-2-oxoethyl]hexanoyl]-methylamino]-3,18-dihydroxy-11-methyl-10,13-dioxo-9-azatricyclo[13.3.1.12,6]icosa-1(18),2,4,6(20),15(19),16-hexaene-8-carboxylic acid;4-(4-chlorophenyl)benzoic acid;methane;methyl (8S,11R,14S)-14-[[(2S)-2-amino-6-[(2-methylpropan-2-yl)oxycarbonylamino]hexanoyl]-methylamino]-3,18-dimethoxy-11-methyl-10,13-dioxo-9-azatricyclo[13.3.1.12,6]icosa-1(18),2,4,6(20),15(19),16-hexaene-8-carboxylate;methyl (8S,11R,14S)-14-[[(2R)-2-[2-[4-(4-chlorophenyl)phenyl]-2-oxoethyl]-6-[(2-methylpropan-2-yl)oxycarbonylamino]hexanoyl]-methylamino]-3,18-dimethoxy-11-methyl-10,13-dioxo-9-azatricyclo[13.3.1.12,6]icosa-1(18),2,4,6(20),15(19),16-hexaene-8-carboxylate;molecular hydrogen?

(8S,11R,14S)-14-[[(2R)-6-amino-2-[2-[4-(4-chlorophenyl)phenyl]-2-oxoethyl]hexanoyl]-methylamino]-3,18-dihydroxy-11-methyl-10,13-dioxo-9-azatricyclo[13.3.1.12,6]icosa-1(18),2,4,6(20),15(19),16-hexaene-8-carboxylic acid;4-(4-chlorophenyl)benzoic acid;methane;methyl (8S,11R,14S)-14-[[(2S)-2-amino-6-[(2-methylpropan-2-yl)oxycarbonylamino]hexanoyl]-methylamino]-3,18-dimethoxy-11-methyl-10,13-dioxo-9-azatricyclo[13.3.1.12,6]icosa-1(18),2,4,6(20),15(19),16-hexaene-8-carboxylate;methyl (8S,11R,14S)-14-[[(2R)-2-[2-[4-(4-chlorophenyl)phenyl]-2-oxoethyl]-6-[(2-methylpropan-2-yl)oxycarbonylamino]hexanoyl]-methylamino]-3,18-dimethoxy-11-methyl-10,13-dioxo-9-azatricyclo[13.3.1.12,6]icosa-1(18),2,4,6(20),15(19),16-hexaene-8-carboxylate;molecular hydrogen has a molecular weight of 2586.31 g/mol, XLogP of 23.44, 37 rotatable bonds, 11 hydrogen bond donors, and 29 hydrogen bond acceptors.

Where does this data come from?

All data for (8S,11R,14S)-14-[[(2R)-6-amino-2-[2-[4-(4-chlorophenyl)phenyl]-2-oxoethyl]hexanoyl]-methylamino]-3,18-dihydroxy-11-methyl-10,13-dioxo-9-azatricyclo[13.3.1.12,6]icosa-1(18),2,4,6(20),15(19),16-hexaene-8-carboxylic acid;4-(4-chlorophenyl)benzoic acid;methane;methyl (8S,11R,14S)-14-[[(2S)-2-amino-6-[(2-methylpropan-2-yl)oxycarbonylamino]hexanoyl]-methylamino]-3,18-dimethoxy-11-methyl-10,13-dioxo-9-azatricyclo[13.3.1.12,6]icosa-1(18),2,4,6(20),15(19),16-hexaene-8-carboxylate;methyl (8S,11R,14S)-14-[[(2R)-2-[2-[4-(4-chlorophenyl)phenyl]-2-oxoethyl]-6-[(2-methylpropan-2-yl)oxycarbonylamino]hexanoyl]-methylamino]-3,18-dimethoxy-11-methyl-10,13-dioxo-9-azatricyclo[13.3.1.12,6]icosa-1(18),2,4,6(20),15(19),16-hexaene-8-carboxylate;molecular hydrogen is sourced from PubChem (CID 157151278), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).