N-[(3'R,4S,6'R,7'S,8'E,11'S)-7-chloro-7'-methoxy-11'-methyl-13',15'-dioxospiro[2,3-dihydro-1H-naphthalene-4,22'-20-oxa-13λ6-thia-1,14-diazatetracyclo[14.7.2.03,6.019,24]pentacosa-8,13,16(25),17,19(24)-pentaene]-13'-yl]-2-(4-methyloxan-4-yl)oxyacetamide;N-[(3'R,4S,6'R,7'S,8'E,11'S)-7'-methoxy-7,11'-dimethyl-13',15'-dioxospiro[2,3-dihydro-1H-naphthalene-4,22'-20-oxa-13λ6-thia-1,14-diazatetracyclo[14.7.2.03,6.019,24]pentacosa-8,13,16(25),17,19(24)-pentaene]-13'-yl]-2-methyl-1,3-thiazole-4-carboxamide;3-methoxy-N-[(3'R,4S,6'R,7'S,8'E,11'S)-7'-methoxy-7,11'-dimethyl-13',15'-dioxospiro[2,3-dihydro-1H-naphthalene-4,22'-20-oxa-13λ6-thia-1,14-diazatetracyclo[14.7.2.03,6.019,24]pentacosa-8,13,16(25),17,19(24)-pentaene]-13'-yl]cyclobutane-1-carboxamide;(3'R,4S,6'R,7'S,8'E,11'S,12'R,13'S)-7'-methoxy-7,11',12'-trimethyl-13'-[2-[1-(oxetan-3-yl)pyrazol-4-yl]-2-oxoethyl]-13'-oxospiro[2,3-dihydro-1H-naphthalene-4,22'-20-oxa-13λ6-thia-1,14-diazatetracyclo[14.7.2.03,6.019,24]pentacosa-8,13,16(25),17,19(24)-pentaene]-15'-one

C159H201ClN14O24S5 — CID 158510203

About N-[(3'R,4S,6'R,7'S,8'E,11'S)-7-chloro-7'-methoxy-11'-methyl-13',15'-dioxospiro[2,3-dihydro-1H-naphthalene-4,22'-20-oxa-13λ6-thia-1,14-diazatetracyclo[14.7.2.03,6.019,24]pentacosa-8,13,16(25),17,19(24)-pentaene]-13'-yl]-2-(4-methyloxan-4-yl)oxyacetamide;N-[(3'R,4S,6'R,7'S,8'E,11'S)-7'-methoxy-7,11'-dimethyl-13',15'-dioxospiro[2,3-dihydro-1H-naphthalene-4,22'-20-oxa-13λ6-thia-1,14-diazatetracyclo[14.7.2.03,6.019,24]pentacosa-8,13,16(25),17,19(24)-pentaene]-13'-yl]-2-methyl-1,3-thiazole-4-carboxamide;3-methoxy-N-[(3'R,4S,6'R,7'S,8'E,11'S)-7'-methoxy-7,11'-dimethyl-13',15'-dioxospiro[2,3-dihydro-1H-naphthalene-4,22'-20-oxa-13λ6-thia-1,14-diazatetracyclo[14.7.2.03,6.019,24]pentacosa-8,13,16(25),17,19(24)-pentaene]-13'-yl]cyclobutane-1-carboxamide;(3'R,4S,6'R,7'S,8'E,11'S,12'R,13'S)-7'-methoxy-7,11',12'-trimethyl-13'-[2-[1-(oxetan-3-yl)pyrazol-4-yl]-2-oxoethyl]-13'-oxospiro[2,3-dihydro-1H-naphthalene-4,22'-20-oxa-13λ6-thia-1,14-diazatetracyclo[14.7.2.03,6.019,24]pentacosa-8,13,16(25),17,19(24)-pentaene]-15'-one

N-[(3'R,4S,6'R,7'S,8'E,11'S)-7-chloro-7'-methoxy-11'-methyl-13',15'-dioxospiro[2,3-dihydro-1H-naphthalene-4,22'-20-oxa-13λ6-thia-1,14-diazatetracyclo[14.7.2.03,6.019,24]pentacosa-8,13,16(25),17,19(24)-pentaene]-13'-yl]-2-(4-methyloxan-4-yl)oxyacetamide;N-[(3'R,4S,6'R,7'S,8'E,11'S)-7'-methoxy-7,11'-dimethyl-13',15'-dioxospiro[2,3-dihydro-1H-naphthalene-4,22'-20-oxa-13λ6-thia-1,14-diazatetracyclo[14.7.2.03,6.019,24]pentacosa-8,13,16(25),17,19(24)-pentaene]-13'-yl]-2-methyl-1,3-thiazole-4-carboxamide;3-methoxy-N-[(3'R,4S,6'R,7'S,8'E,11'S)-7'-methoxy-7,11'-dimethyl-13',15'-dioxospiro[2,3-dihydro-1H-naphthalene-4,22'-20-oxa-13λ6-thia-1,14-diazatetracyclo[14.7.2.03,6.019,24]pentacosa-8,13,16(25),17,19(24)-pentaene]-13'-yl]cyclobutane-1-carboxamide;(3'R,4S,6'R,7'S,8'E,11'S,12'R,13'S)-7'-methoxy-7,11',12'-trimethyl-13'-[2-[1-(oxetan-3-yl)pyrazol-4-yl]-2-oxoethyl]-13'-oxospiro[2,3-dihydro-1H-naphthalene-4,22'-20-oxa-13λ6-thia-1,14-diazatetracyclo[14.7.2.03,6.019,24]pentacosa-8,13,16(25),17,19(24)-pentaene]-15'-one (PubChem CID 158510203) has the molecular formula C159H201ClN14O24S5 and a molecular weight of 2888.22 g/mol. Its IUPAC name is N-[(3'R,4S,6'R,7'S,8'E,11'S)-7-chloro-7'-methoxy-11'-methyl-13',15'-dioxospiro[2,3-dihydro-1H-naphthalene-4,22'-20-oxa-13λ6-thia-1,14-diazatetracyclo[14.7.2.03,6.019,24]pentacosa-8,13,16(25),17,19(24)-pentaene]-13'-yl]-2-(4-methyloxan-4-yl)oxyacetamide;N-[(3'R,4S,6'R,7'S,8'E,11'S)-7'-methoxy-7,11'-dimethyl-13',15'-dioxospiro[2,3-dihydro-1H-naphthalene-4,22'-20-oxa-13λ6-thia-1,14-diazatetracyclo[14.7.2.03,6.019,24]pentacosa-8,13,16(25),17,19(24)-pentaene]-13'-yl]-2-methyl-1,3-thiazole-4-carboxamide;3-methoxy-N-[(3'R,4S,6'R,7'S,8'E,11'S)-7'-methoxy-7,11'-dimethyl-13',15'-dioxospiro[2,3-dihydro-1H-naphthalene-4,22'-20-oxa-13λ6-thia-1,14-diazatetracyclo[14.7.2.03,6.019,24]pentacosa-8,13,16(25),17,19(24)-pentaene]-13'-yl]cyclobutane-1-carboxamide;(3'R,4S,6'R,7'S,8'E,11'S,12'R,13'S)-7'-methoxy-7,11',12'-trimethyl-13'-[2-[1-(oxetan-3-yl)pyrazol-4-yl]-2-oxoethyl]-13'-oxospiro[2,3-dihydro-1H-naphthalene-4,22'-20-oxa-13λ6-thia-1,14-diazatetracyclo[14.7.2.03,6.019,24]pentacosa-8,13,16(25),17,19(24)-pentaene]-15'-one.

Molecular Properties

• Compound Name: N-[(3'R,4S,6'R,7'S,8'E,11'S)-7-chloro-7'-methoxy-11'-methyl-13',15'-dioxospiro[2,3-dihydro-1H-naphthalene-4,22'-20-oxa-13λ6-thia-1,14-diazatetracyclo[14.7.2.03,6.019,24]pentacosa-8,13,16(25),17,19(24)-pentaene]-13'-yl]-2-(4-methyloxan-4-yl)oxyacetamide;N-[(3'R,4S,6'R,7'S,8'E,11'S)-7'-methoxy-7,11'-dimethyl-13',15'-dioxospiro[2,3-dihydro-1H-naphthalene-4,22'-20-oxa-13λ6-thia-1,14-diazatetracyclo[14.7.2.03,6.019,24]pentacosa-8,13,16(25),17,19(24)-pentaene]-13'-yl]-2-methyl-1,3-thiazole-4-carboxamide;3-methoxy-N-[(3'R,4S,6'R,7'S,8'E,11'S)-7'-methoxy-7,11'-dimethyl-13',15'-dioxospiro[2,3-dihydro-1H-naphthalene-4,22'-20-oxa-13λ6-thia-1,14-diazatetracyclo[14.7.2.03,6.019,24]pentacosa-8,13,16(25),17,19(24)-pentaene]-13'-yl]cyclobutane-1-carboxamide;(3'R,4S,6'R,7'S,8'E,11'S,12'R,13'S)-7'-methoxy-7,11',12'-trimethyl-13'-[2-[1-(oxetan-3-yl)pyrazol-4-yl]-2-oxoethyl]-13'-oxospiro[2,3-dihydro-1H-naphthalene-4,22'-20-oxa-13λ6-thia-1,14-diazatetracyclo[14.7.2.03,6.019,24]pentacosa-8,13,16(25),17,19(24)-pentaene]-15'-one
• PubChem CID: 158510203
• Molecular Formula: C159H201ClN14O24S5
• Molecular Weight: 2888.22 g/mol
• Exact Mass: 2885.32
• IUPAC Name: N-[(3'R,4S,6'R,7'S,8'E,11'S)-7-chloro-7'-methoxy-11'-methyl-13',15'-dioxospiro[2,3-dihydro-1H-naphthalene-4,22'-20-oxa-13λ6-thia-1,14-diazatetracyclo[14.7.2.03,6.019,24]pentacosa-8,13,16(25),17,19(24)-pentaene]-13'-yl]-2-(4-methyloxan-4-yl)oxyacetamide;N-[(3'R,4S,6'R,7'S,8'E,11'S)-7'-methoxy-7,11'-dimethyl-13',15'-dioxospiro[2,3-dihydro-1H-naphthalene-4,22'-20-oxa-13λ6-thia-1,14-diazatetracyclo[14.7.2.03,6.019,24]pentacosa-8,13,16(25),17,19(24)-pentaene]-13'-yl]-2-methyl-1,3-thiazole-4-carboxamide;3-methoxy-N-[(3'R,4S,6'R,7'S,8'E,11'S)-7'-methoxy-7,11'-dimethyl-13',15'-dioxospiro[2,3-dihydro-1H-naphthalene-4,22'-20-oxa-13λ6-thia-1,14-diazatetracyclo[14.7.2.03,6.019,24]pentacosa-8,13,16(25),17,19(24)-pentaene]-13'-yl]cyclobutane-1-carboxamide;(3'R,4S,6'R,7'S,8'E,11'S,12'R,13'S)-7'-methoxy-7,11',12'-trimethyl-13'-[2-[1-(oxetan-3-yl)pyrazol-4-yl]-2-oxoethyl]-13'-oxospiro[2,3-dihydro-1H-naphthalene-4,22'-20-oxa-13λ6-thia-1,14-diazatetracyclo[14.7.2.03,6.019,24]pentacosa-8,13,16(25),17,19(24)-pentaene]-15'-one
• SMILES: COC1CC(C(=O)NS2(=O)=NC(=O)c3ccc4c(c3)N(C[C@@H]3CC[C@H]3[C@@H](OC)/C=C/C[C@H](C)C2)C[C@@]2(CCCc3cc(C)ccc32)CO4)C1.CO[C@H]1/C=C/C[C@H](C)CS(=O)(NC(=O)COC2(C)CCOCC2)=NC(=O)c2ccc3c(c2)N(C[C@@H]2CC[C@H]21)C[C@@]1(CCCc2cc(Cl)ccc21)CO3.CO[C@H]1/C=C/C[C@H](C)CS(=O)(NC(=O)c2csc(C)n2)=NC(=O)c2ccc3c(c2)N(C[C@@H]2CC[C@H]21)C[C@@]1(CCCc2cc(C)ccc21)CO3.CO[C@H]1/C=C/C[C@H](C)[C@@H](C)[S@@](=O)(CC(=O)c2cnn(C3COC3)c2)=NC(=O)c2ccc3c(c2)N(C[C@@H]2CC[C@H]21)C[C@@]1(CCCc2cc(C)ccc21)CO3
• InChI: InChI=1S/C42H52N4O6S.C40H52ClN3O7S.C39H51N3O6S.C38H46N4O5S2/c1-27-10-14-36-30(17-27)8-6-16-42(36)25-45-20-32-11-13-35(32)39(50-4)9-5-7-28(2)29(3)53(49,24-38(47)33-19-43-46(21-33)34-22-51-23-34)44-41(48)31-12-15-40(52-26-42)37(45)18-31;1-27-6-4-8-35(48-3)32-12-9-30(32)22-44-25-40(15-5-7-28-20-31(41)11-13-33(28)40)26-50-36-14-10-29(21-34(36)44)38(46)43-52(47,24-27)42-37(45)23-51-39(2)16-18-49-19-17-39;1-25-10-14-33-27(17-25)8-6-16-39(33)23-42-21-29-11-13-32(29)35(47-4)9-5-7-26(2)22-49(45,41-38(44)30-18-31(19-30)46-3)40-37(43)28-12-15-36(48-24-39)34(42)20-28;1-24-10-14-31-27(17-24)8-6-16-38(31)22-42-19-29-11-13-30(29)34(46-4)9-5-7-25(2)21-49(45,41-37(44)32-20-48-26(3)39-32)40-36(43)28-12-15-35(47-23-38)33(42)18-28/h5,9-10,12,14-15,17-19,21,28-29,32,34-35,39H,6-8,11,13,16,20,22-26H2,1-4H3;4,8,10-11,13-14,20-21,27,30,32,35H,5-7,9,12,15-19,22-26H2,1-3H3,(H,42,43,45,46,47);5,9-10,12,14-15,17,20,26,29-32,35H,6-8,11,13,16,18-19,21-24H2,1-4H3,(H,40,41,43,44,45);5,9-10,12,14-15,17-18,20,25,29-30,34H,6-8,11,13,16,19,21-23H2,1-4H3,(H,40,41,43,44,45)/b9-5+;8-4+;2*9-5+/t28-,29+,32-,35+,39-,42-,53-;27-,30-,32+,35-,40-,52?;26-,29-,30?,31?,32+,35-,39-,49?;25-,29-,30+,34-,38-,49?/m0000/s1
• InChIKey: HKYLGCZSBXNBBJ-PERIAGPQSA-N
• XLogP: 26.42
• TPSA: 444.80 Ų
• H-Bond Donors: 3
• H-Bond Acceptors: 32
• Rotatable Bonds: 17
• Heavy Atoms: 203
• Complexity: —

Lipinski Rule of Five

3 violations

Rule	Value
MW ≤ 500	2888.22
LogP ≤ 5	26.42
H-Bond Donors ≤ 5	3
H-Bond Acceptors ≤ 10	32

Computed Properties (RDKit)

• Structural Alerts: {'alert_name': 'isolated_alkene', 'substructure': 'N/A'}

Frequently Asked Questions

What is the IUPAC name of N-[(3'R,4S,6'R,7'S,8'E,11'S)-7-chloro-7'-methoxy-11'-methyl-13',15'-dioxospiro[2,3-dihydro-1H-naphthalene-4,22'-20-oxa-13λ6-thia-1,14-diazatetracyclo[14.7.2.03,6.019,24]pentacosa-8,13,16(25),17,19(24)-pentaene]-13'-yl]-2-(4-methyloxan-4-yl)oxyacetamide;N-[(3'R,4S,6'R,7'S,8'E,11'S)-7'-methoxy-7,11'-dimethyl-13',15'-dioxospiro[2,3-dihydro-1H-naphthalene-4,22'-20-oxa-13λ6-thia-1,14-diazatetracyclo[14.7.2.03,6.019,24]pentacosa-8,13,16(25),17,19(24)-pentaene]-13'-yl]-2-methyl-1,3-thiazole-4-carboxamide;3-methoxy-N-[(3'R,4S,6'R,7'S,8'E,11'S)-7'-methoxy-7,11'-dimethyl-13',15'-dioxospiro[2,3-dihydro-1H-naphthalene-4,22'-20-oxa-13λ6-thia-1,14-diazatetracyclo[14.7.2.03,6.019,24]pentacosa-8,13,16(25),17,19(24)-pentaene]-13'-yl]cyclobutane-1-carboxamide;(3'R,4S,6'R,7'S,8'E,11'S,12'R,13'S)-7'-methoxy-7,11',12'-trimethyl-13'-[2-[1-(oxetan-3-yl)pyrazol-4-yl]-2-oxoethyl]-13'-oxospiro[2,3-dihydro-1H-naphthalene-4,22'-20-oxa-13λ6-thia-1,14-diazatetracyclo[14.7.2.03,6.019,24]pentacosa-8,13,16(25),17,19(24)-pentaene]-15'-one?

The IUPAC name of N-[(3'R,4S,6'R,7'S,8'E,11'S)-7-chloro-7'-methoxy-11'-methyl-13',15'-dioxospiro[2,3-dihydro-1H-naphthalene-4,22'-20-oxa-13λ6-thia-1,14-diazatetracyclo[14.7.2.03,6.019,24]pentacosa-8,13,16(25),17,19(24)-pentaene]-13'-yl]-2-(4-methyloxan-4-yl)oxyacetamide;N-[(3'R,4S,6'R,7'S,8'E,11'S)-7'-methoxy-7,11'-dimethyl-13',15'-dioxospiro[2,3-dihydro-1H-naphthalene-4,22'-20-oxa-13λ6-thia-1,14-diazatetracyclo[14.7.2.03,6.019,24]pentacosa-8,13,16(25),17,19(24)-pentaene]-13'-yl]-2-methyl-1,3-thiazole-4-carboxamide;3-methoxy-N-[(3'R,4S,6'R,7'S,8'E,11'S)-7'-methoxy-7,11'-dimethyl-13',15'-dioxospiro[2,3-dihydro-1H-naphthalene-4,22'-20-oxa-13λ6-thia-1,14-diazatetracyclo[14.7.2.03,6.019,24]pentacosa-8,13,16(25),17,19(24)-pentaene]-13'-yl]cyclobutane-1-carboxamide;(3'R,4S,6'R,7'S,8'E,11'S,12'R,13'S)-7'-methoxy-7,11',12'-trimethyl-13'-[2-[1-(oxetan-3-yl)pyrazol-4-yl]-2-oxoethyl]-13'-oxospiro[2,3-dihydro-1H-naphthalene-4,22'-20-oxa-13λ6-thia-1,14-diazatetracyclo[14.7.2.03,6.019,24]pentacosa-8,13,16(25),17,19(24)-pentaene]-15'-one (CID 158510203) is N-[(3'R,4S,6'R,7'S,8'E,11'S)-7-chloro-7'-methoxy-11'-methyl-13',15'-dioxospiro[2,3-dihydro-1H-naphthalene-4,22'-20-oxa-13λ6-thia-1,14-diazatetracyclo[14.7.2.03,6.019,24]pentacosa-8,13,16(25),17,19(24)-pentaene]-13'-yl]-2-(4-methyloxan-4-yl)oxyacetamide;N-[(3'R,4S,6'R,7'S,8'E,11'S)-7'-methoxy-7,11'-dimethyl-13',15'-dioxospiro[2,3-dihydro-1H-naphthalene-4,22'-20-oxa-13λ6-thia-1,14-diazatetracyclo[14.7.2.03,6.019,24]pentacosa-8,13,16(25),17,19(24)-pentaene]-13'-yl]-2-methyl-1,3-thiazole-4-carboxamide;3-methoxy-N-[(3'R,4S,6'R,7'S,8'E,11'S)-7'-methoxy-7,11'-dimethyl-13',15'-dioxospiro[2,3-dihydro-1H-naphthalene-4,22'-20-oxa-13λ6-thia-1,14-diazatetracyclo[14.7.2.03,6.019,24]pentacosa-8,13,16(25),17,19(24)-pentaene]-13'-yl]cyclobutane-1-carboxamide;(3'R,4S,6'R,7'S,8'E,11'S,12'R,13'S)-7'-methoxy-7,11',12'-trimethyl-13'-[2-[1-(oxetan-3-yl)pyrazol-4-yl]-2-oxoethyl]-13'-oxospiro[2,3-dihydro-1H-naphthalene-4,22'-20-oxa-13λ6-thia-1,14-diazatetracyclo[14.7.2.03,6.019,24]pentacosa-8,13,16(25),17,19(24)-pentaene]-15'-one.

What is the SMILES notation for N-[(3'R,4S,6'R,7'S,8'E,11'S)-7-chloro-7'-methoxy-11'-methyl-13',15'-dioxospiro[2,3-dihydro-1H-naphthalene-4,22'-20-oxa-13λ6-thia-1,14-diazatetracyclo[14.7.2.03,6.019,24]pentacosa-8,13,16(25),17,19(24)-pentaene]-13'-yl]-2-(4-methyloxan-4-yl)oxyacetamide;N-[(3'R,4S,6'R,7'S,8'E,11'S)-7'-methoxy-7,11'-dimethyl-13',15'-dioxospiro[2,3-dihydro-1H-naphthalene-4,22'-20-oxa-13λ6-thia-1,14-diazatetracyclo[14.7.2.03,6.019,24]pentacosa-8,13,16(25),17,19(24)-pentaene]-13'-yl]-2-methyl-1,3-thiazole-4-carboxamide;3-methoxy-N-[(3'R,4S,6'R,7'S,8'E,11'S)-7'-methoxy-7,11'-dimethyl-13',15'-dioxospiro[2,3-dihydro-1H-naphthalene-4,22'-20-oxa-13λ6-thia-1,14-diazatetracyclo[14.7.2.03,6.019,24]pentacosa-8,13,16(25),17,19(24)-pentaene]-13'-yl]cyclobutane-1-carboxamide;(3'R,4S,6'R,7'S,8'E,11'S,12'R,13'S)-7'-methoxy-7,11',12'-trimethyl-13'-[2-[1-(oxetan-3-yl)pyrazol-4-yl]-2-oxoethyl]-13'-oxospiro[2,3-dihydro-1H-naphthalene-4,22'-20-oxa-13λ6-thia-1,14-diazatetracyclo[14.7.2.03,6.019,24]pentacosa-8,13,16(25),17,19(24)-pentaene]-15'-one?

The canonical SMILES for N-[(3'R,4S,6'R,7'S,8'E,11'S)-7-chloro-7'-methoxy-11'-methyl-13',15'-dioxospiro[2,3-dihydro-1H-naphthalene-4,22'-20-oxa-13λ6-thia-1,14-diazatetracyclo[14.7.2.03,6.019,24]pentacosa-8,13,16(25),17,19(24)-pentaene]-13'-yl]-2-(4-methyloxan-4-yl)oxyacetamide;N-[(3'R,4S,6'R,7'S,8'E,11'S)-7'-methoxy-7,11'-dimethyl-13',15'-dioxospiro[2,3-dihydro-1H-naphthalene-4,22'-20-oxa-13λ6-thia-1,14-diazatetracyclo[14.7.2.03,6.019,24]pentacosa-8,13,16(25),17,19(24)-pentaene]-13'-yl]-2-methyl-1,3-thiazole-4-carboxamide;3-methoxy-N-[(3'R,4S,6'R,7'S,8'E,11'S)-7'-methoxy-7,11'-dimethyl-13',15'-dioxospiro[2,3-dihydro-1H-naphthalene-4,22'-20-oxa-13λ6-thia-1,14-diazatetracyclo[14.7.2.03,6.019,24]pentacosa-8,13,16(25),17,19(24)-pentaene]-13'-yl]cyclobutane-1-carboxamide;(3'R,4S,6'R,7'S,8'E,11'S,12'R,13'S)-7'-methoxy-7,11',12'-trimethyl-13'-[2-[1-(oxetan-3-yl)pyrazol-4-yl]-2-oxoethyl]-13'-oxospiro[2,3-dihydro-1H-naphthalene-4,22'-20-oxa-13λ6-thia-1,14-diazatetracyclo[14.7.2.03,6.019,24]pentacosa-8,13,16(25),17,19(24)-pentaene]-15'-one is COC1CC(C(=O)NS2(=O)=NC(=O)c3ccc4c(c3)N(C[C@@H]3CC[C@H]3[C@@H](OC)/C=C/C[C@H](C)C2)C[C@@]2(CCCc3cc(C)ccc32)CO4)C1.CO[C@H]1/C=C/C[C@H](C)CS(=O)(NC(=O)COC2(C)CCOCC2)=NC(=O)c2ccc3c(c2)N(C[C@@H]2CC[C@H]21)C[C@@]1(CCCc2cc(Cl)ccc21)CO3.CO[C@H]1/C=C/C[C@H](C)CS(=O)(NC(=O)c2csc(C)n2)=NC(=O)c2ccc3c(c2)N(C[C@@H]2CC[C@H]21)C[C@@]1(CCCc2cc(C)ccc21)CO3.CO[C@H]1/C=C/C[C@H](C)[C@@H](C)[S@@](=O)(CC(=O)c2cnn(C3COC3)c2)=NC(=O)c2ccc3c(c2)N(C[C@@H]2CC[C@H]21)C[C@@]1(CCCc2cc(C)ccc21)CO3.

What is the InChIKey of N-[(3'R,4S,6'R,7'S,8'E,11'S)-7-chloro-7'-methoxy-11'-methyl-13',15'-dioxospiro[2,3-dihydro-1H-naphthalene-4,22'-20-oxa-13λ6-thia-1,14-diazatetracyclo[14.7.2.03,6.019,24]pentacosa-8,13,16(25),17,19(24)-pentaene]-13'-yl]-2-(4-methyloxan-4-yl)oxyacetamide;N-[(3'R,4S,6'R,7'S,8'E,11'S)-7'-methoxy-7,11'-dimethyl-13',15'-dioxospiro[2,3-dihydro-1H-naphthalene-4,22'-20-oxa-13λ6-thia-1,14-diazatetracyclo[14.7.2.03,6.019,24]pentacosa-8,13,16(25),17,19(24)-pentaene]-13'-yl]-2-methyl-1,3-thiazole-4-carboxamide;3-methoxy-N-[(3'R,4S,6'R,7'S,8'E,11'S)-7'-methoxy-7,11'-dimethyl-13',15'-dioxospiro[2,3-dihydro-1H-naphthalene-4,22'-20-oxa-13λ6-thia-1,14-diazatetracyclo[14.7.2.03,6.019,24]pentacosa-8,13,16(25),17,19(24)-pentaene]-13'-yl]cyclobutane-1-carboxamide;(3'R,4S,6'R,7'S,8'E,11'S,12'R,13'S)-7'-methoxy-7,11',12'-trimethyl-13'-[2-[1-(oxetan-3-yl)pyrazol-4-yl]-2-oxoethyl]-13'-oxospiro[2,3-dihydro-1H-naphthalene-4,22'-20-oxa-13λ6-thia-1,14-diazatetracyclo[14.7.2.03,6.019,24]pentacosa-8,13,16(25),17,19(24)-pentaene]-15'-one?

The InChIKey is HKYLGCZSBXNBBJ-PERIAGPQSA-N. The full InChI is InChI=1S/C42H52N4O6S.C40H52ClN3O7S.C39H51N3O6S.C38H46N4O5S2/c1-27-10-14-36-30(17-27)8-6-16-42(36)25-45-20-32-11-13-35(32)39(50-4)9-5-7-28(2)29(3)53(49,24-38(47)33-19-43-46(21-33)34-22-51-23-34)44-41(48)31-12-15-40(52-26-42)37(45)18-31;1-27-6-4-8-35(48-3)32-12-9-30(32)22-44-25-40(15-5-7-28-20-31(41)11-13-33(28)40)26-50-36-14-10-29(21-34(36)44)38(46)43-52(47,24-27)42-37(45)23-51-39(2)16-18-49-19-17-39;1-25-10-14-33-27(17-25)8-6-16-39(33)23-42-21-29-11-13-32(29)35(47-4)9-5-7-26(2)22-49(45,41-38(44)30-18-31(19-30)46-3)40-37(43)28-12-15-36(48-24-39)34(42)20-28;1-24-10-14-31-27(17-24)8-6-16-38(31)22-42-19-29-11-13-30(29)34(46-4)9-5-7-25(2)21-49(45,41-37(44)32-20-48-26(3)39-32)40-36(43)28-12-15-35(47-23-38)33(42)18-28/h5,9-10,12,14-15,17-19,21,28-29,32,34-35,39H,6-8,11,13,16,20,22-26H2,1-4H3;4,8,10-11,13-14,20-21,27,30,32,35H,5-7,9,12,15-19,22-26H2,1-3H3,(H,42,43,45,46,47);5,9-10,12,14-15,17,20,26,29-32,35H,6-8,11,13,16,18-19,21-24H2,1-4H3,(H,40,41,43,44,45);5,9-10,12,14-15,17-18,20,25,29-30,34H,6-8,11,13,16,19,21-23H2,1-4H3,(H,40,41,43,44,45)/b9-5+;8-4+;2*9-5+/t28-,29+,32-,35+,39-,42-,53-;27-,30-,32+,35-,40-,52?;26-,29-,30?,31?,32+,35-,39-,49?;25-,29-,30+,34-,38-,49?/m0000/s1.

What are the key properties of N-[(3'R,4S,6'R,7'S,8'E,11'S)-7-chloro-7'-methoxy-11'-methyl-13',15'-dioxospiro[2,3-dihydro-1H-naphthalene-4,22'-20-oxa-13λ6-thia-1,14-diazatetracyclo[14.7.2.03,6.019,24]pentacosa-8,13,16(25),17,19(24)-pentaene]-13'-yl]-2-(4-methyloxan-4-yl)oxyacetamide;N-[(3'R,4S,6'R,7'S,8'E,11'S)-7'-methoxy-7,11'-dimethyl-13',15'-dioxospiro[2,3-dihydro-1H-naphthalene-4,22'-20-oxa-13λ6-thia-1,14-diazatetracyclo[14.7.2.03,6.019,24]pentacosa-8,13,16(25),17,19(24)-pentaene]-13'-yl]-2-methyl-1,3-thiazole-4-carboxamide;3-methoxy-N-[(3'R,4S,6'R,7'S,8'E,11'S)-7'-methoxy-7,11'-dimethyl-13',15'-dioxospiro[2,3-dihydro-1H-naphthalene-4,22'-20-oxa-13λ6-thia-1,14-diazatetracyclo[14.7.2.03,6.019,24]pentacosa-8,13,16(25),17,19(24)-pentaene]-13'-yl]cyclobutane-1-carboxamide;(3'R,4S,6'R,7'S,8'E,11'S,12'R,13'S)-7'-methoxy-7,11',12'-trimethyl-13'-[2-[1-(oxetan-3-yl)pyrazol-4-yl]-2-oxoethyl]-13'-oxospiro[2,3-dihydro-1H-naphthalene-4,22'-20-oxa-13λ6-thia-1,14-diazatetracyclo[14.7.2.03,6.019,24]pentacosa-8,13,16(25),17,19(24)-pentaene]-15'-one?

N-[(3'R,4S,6'R,7'S,8'E,11'S)-7-chloro-7'-methoxy-11'-methyl-13',15'-dioxospiro[2,3-dihydro-1H-naphthalene-4,22'-20-oxa-13λ6-thia-1,14-diazatetracyclo[14.7.2.03,6.019,24]pentacosa-8,13,16(25),17,19(24)-pentaene]-13'-yl]-2-(4-methyloxan-4-yl)oxyacetamide;N-[(3'R,4S,6'R,7'S,8'E,11'S)-7'-methoxy-7,11'-dimethyl-13',15'-dioxospiro[2,3-dihydro-1H-naphthalene-4,22'-20-oxa-13λ6-thia-1,14-diazatetracyclo[14.7.2.03,6.019,24]pentacosa-8,13,16(25),17,19(24)-pentaene]-13'-yl]-2-methyl-1,3-thiazole-4-carboxamide;3-methoxy-N-[(3'R,4S,6'R,7'S,8'E,11'S)-7'-methoxy-7,11'-dimethyl-13',15'-dioxospiro[2,3-dihydro-1H-naphthalene-4,22'-20-oxa-13λ6-thia-1,14-diazatetracyclo[14.7.2.03,6.019,24]pentacosa-8,13,16(25),17,19(24)-pentaene]-13'-yl]cyclobutane-1-carboxamide;(3'R,4S,6'R,7'S,8'E,11'S,12'R,13'S)-7'-methoxy-7,11',12'-trimethyl-13'-[2-[1-(oxetan-3-yl)pyrazol-4-yl]-2-oxoethyl]-13'-oxospiro[2,3-dihydro-1H-naphthalene-4,22'-20-oxa-13λ6-thia-1,14-diazatetracyclo[14.7.2.03,6.019,24]pentacosa-8,13,16(25),17,19(24)-pentaene]-15'-one has a molecular weight of 2888.22 g/mol, XLogP of 26.42, 17 rotatable bonds, 3 hydrogen bond donors, and 32 hydrogen bond acceptors.

Where does this data come from?

All data for N-[(3'R,4S,6'R,7'S,8'E,11'S)-7-chloro-7'-methoxy-11'-methyl-13',15'-dioxospiro[2,3-dihydro-1H-naphthalene-4,22'-20-oxa-13λ6-thia-1,14-diazatetracyclo[14.7.2.03,6.019,24]pentacosa-8,13,16(25),17,19(24)-pentaene]-13'-yl]-2-(4-methyloxan-4-yl)oxyacetamide;N-[(3'R,4S,6'R,7'S,8'E,11'S)-7'-methoxy-7,11'-dimethyl-13',15'-dioxospiro[2,3-dihydro-1H-naphthalene-4,22'-20-oxa-13λ6-thia-1,14-diazatetracyclo[14.7.2.03,6.019,24]pentacosa-8,13,16(25),17,19(24)-pentaene]-13'-yl]-2-methyl-1,3-thiazole-4-carboxamide;3-methoxy-N-[(3'R,4S,6'R,7'S,8'E,11'S)-7'-methoxy-7,11'-dimethyl-13',15'-dioxospiro[2,3-dihydro-1H-naphthalene-4,22'-20-oxa-13λ6-thia-1,14-diazatetracyclo[14.7.2.03,6.019,24]pentacosa-8,13,16(25),17,19(24)-pentaene]-13'-yl]cyclobutane-1-carboxamide;(3'R,4S,6'R,7'S,8'E,11'S,12'R,13'S)-7'-methoxy-7,11',12'-trimethyl-13'-[2-[1-(oxetan-3-yl)pyrazol-4-yl]-2-oxoethyl]-13'-oxospiro[2,3-dihydro-1H-naphthalene-4,22'-20-oxa-13λ6-thia-1,14-diazatetracyclo[14.7.2.03,6.019,24]pentacosa-8,13,16(25),17,19(24)-pentaene]-15'-one is sourced from PubChem (CID 158510203), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).