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cobalt(3+); methyl 3-[(2Z,3S,4S)-2-[[(2Z,3S)-2-[1-[(2R,3R,4R)-2-[(3S,4S,5R)-2-ethanoyl-4-(2-methoxy-2-oxidanylidene-ethyl)-3-(3-methoxy-3-oxidanylidene-propyl)-4,5-dimethyl-3H-pyrrol-5-yl]-3-(2-methoxy-2-oxidanylidene-ethyl)-4-(3-methoxy-3-oxidanylidene-propyl)-4-methyl-2,3-dihydropyrrol-5-yl]ethylidene]-3-(3-methoxy-3-oxidanylidene-propyl)-4,4-dimethyl-3H-pyrrol-5-yl]methylidene]-4-(2-methoxy-2-oxidanylidene-ethyl)-4-methyl-5-oxidanylidene-pyrrolidin-1-id-3-yl]propanoate; dicyanide

Systemtic Name:	cobalt(3+); methyl 3-[(2Z,3S,4S)-2-[[(2Z,3S)-2-[1-[(2R,3R,4R)-2-[(3S,4S,5R)-2-ethanoyl-4-(2-methoxy-2-oxidanylidene-ethyl)-3-(3-methoxy-3-oxidanylidene-propyl)-4,5-dimethyl-3H-pyrrol-5-yl]-3-(2-methoxy-2-oxidanylidene-ethyl)-4-(3-methoxy-3-oxidanylidene-propyl)-4-methyl-2,3-dihydropyrrol-5-yl]ethylidene]-3-(3-methoxy-3-oxidanylidene-propyl)-4,4-dimethyl-3H-pyrrol-5-yl]methylidene]-4-(2-methoxy-2-oxidanylidene-ethyl)-4-methyl-5-oxidanylidene-pyrrolidin-1-id-3-yl]propanoate; dicyanide
Openeye Name:	cobaltic methyl 3-[(2Z,3S,4S)-2-[[(2Z,3S)-2-[1-[(2R,3R,4R)-2-[(3S,4S,5R)-2-acetyl-4-(2-methoxy-2-oxo-ethyl)-3-(3-methoxy-3-oxo-propyl)-4,5-dimethyl-3H-pyrrol-5-yl]-3-(2-methoxy-2-oxo-ethyl)-4-(3-methoxy-3-oxo-propyl)-4-methyl-2,3-dihydropyrrol-5-yl]ethylidene]-3-(3-methoxy-3-oxo-propyl)-4,4-dimethyl-3H-pyrrol-5-yl]methylene]-4-(2-methoxy-2-oxo-ethyl)-4-methyl-5-oxo-pyrrolidin-1-id-3-yl]propanoate dicyanide
CAS Name:	3-[(2Z,3S,4S)-2-[[(2Z,3S)-2-[1-[(2R,3R,4R)-2-[(3S,4S,5R)-2-acetyl-4-(2-methoxy-2-oxoethyl)-3-(3-methoxy-3-oxopropyl)-4,5-dimethyl-3H-pyrrol-5-yl]-3-(2-methoxy-2-oxoethyl)-4-(3-methoxy-3-oxopropyl)-4-methyl-2,3-dihydropyrrol-5-yl]ethylidene]-3-(3-methoxy-3-oxopropyl)-4,4-dimethyl-3H-pyrrol-5-yl]methylidene]-4-(2-methoxy-2-oxoethyl)-4-methyl-5-oxo-3-pyrrolidin-1-idyl]propanoic acid methyl ester; cobalt(3+); dicyanide
IUPAC Name:	cobalt(3+); methyl 3-[(2Z,3S,4S)-2-[[(2Z,3S)-2-[1-[(2R,3R,4R)-2-[(3S,4S,5R)-2-acetyl-4-(2-methoxy-2-oxoethyl)-3-(3-methoxy-3-oxopropyl)-4,5-dimethyl-3H-pyrrol-5-yl]-3-(2-methoxy-2-oxoethyl)-4-(3-methoxy-3-oxopropyl)-4-methyl-2,3-dihydropyrrol-5-yl]ethylidene]-3-(3-methoxy-3-oxopropyl)-4,4-dimethyl-3H-pyrrol-5-yl]methylidene]-4-(2-methoxy-2-oxoethyl)-4-methyl-5-oxopyrrolidin-1-id-3-yl]propanoate; dicyanide
Traditional Name:	cobaltic 3-[(2Z,3S,4S)-2-[[(4S,5Z)-5-[1-[(3R,4R,5R)-5-[(2R,3S,4S)-5-acetyl-3-(2-keto-2-methoxy-ethyl)-4-(3-keto-3-methoxy-propyl)-2,3-dimethyl-1-pyrrolin-2-yl]-4-(2-keto-2-methoxy-ethyl)-3-(3-keto-3-methoxy-propyl)-3-methyl-1-pyrrolin-2-yl]ethylidene]-4-(3-keto-3-methoxy-propyl)-3,3-dimethyl-1-pyrrolin-2-yl]methylene]-5-keto-4-(2-keto-2-methoxy-ethyl)-4-methyl-pyrrolidin-1-id-3-yl]propionic acid methyl ester dicyanide
Formula:	C₅₄H₇₃CoN₆O₁₆
MolecularWeight:	1137.061556

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Descriptors Computed from Structure

Canonical SMILES:

CC(=C1C(C(C(=N1)C=C2C(C(C(=O)[N-]2)(C)CC(=O)OC)CCC(=O)OC)(C)C)CCC(=O)OC)C3=NC(C(C3(C)CCC(=O)OC)CC(=O)OC)C4(C(C(C(=N4)C(=O)C)CCC(=O)OC)(C)CC(=O)OC)C.[C-]#N.[C-]#N.[Co+3]

Isomeric SMILES

CC(=O)C1=N[14C@@]([C@@]([14C@@H]1CCC(=O)OC)(C)CC(=O)OC)(C)[14C@H]2[C@@H]([14C@@](C(=N2)/C(=C\3/[14C@H](C([14C](=N3)/C=C\4/[14C@H]([C@]([14C](=O)[N-]4)(C)CC(=O)OC)CCC(=O)OC)(C)C)CCC(=O)OC)/C)(C)CCC(=O)OC)CC(=O)OC.[C-]#N.[C-]#N.[Co+3]

InChI

InChI=1S/C52H74N4O16.2CN.Co/c1-28(43-31(17-20-37(59)67-10)48(3,4)35(54-43)25-34-30(16-19-36(58)66-9)50(6,47(65)53-34)26-41(63)71-14)45-49(5,23-22-39(61)69-12)33(24-40(62)70-13)46(55-45)52(8)51(7,27-42(64)72-15)32(18-21-38(60)68-11)44(56-52)29(2)57;2*1-2;/h25,30-33,46H,16-24,26-27H2,1-15H3,(H,53,54,55,65);;;/q;2*-1;+3/p-1/t30-,31-,32-,33+,46-,49-,50+,51+,52+;;;/m1.../s1/i30+2,31+2,32+2,35+2,46+2,47+2,49+2,52+2;;;

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