[(2S,3R,4S,5S,6S)-2-acetyloxy-4,5-dimethyl-6-[[(2R,3R,4S,5R,6R)-3,4,5-triacetyloxy-6-(hydroxymethyl)oxan-2-yl]oxymethyl]oxan-3-yl] acetate;2-[9-[1-carboxy-3-[[(2R,3S,4S,5R,6R)-3,4,5-trihydroxy-6-[[(2R,3S,4S,5R,6R)-3,4,5,6-tetrahydroxyoxan-2-yl]methoxy]oxan-2-yl]methoxycarbothioylamino]propyl]-6-[3-[[(2R,3S,4S,5R,6R)-3,4,5-trihydroxy-6-[[(2R,3S,4S,5R,6R)-3,4,5,6-tetrahydroxyoxan-2-yl]methoxy]oxan-2-yl]methoxycarbothioylamino]propyl]-3,6,9,15-tetrazabicyclo[9.3.1]pentadeca-1(15),11,13-trien-3-yl]-4-[[(2R,3S,4S,5R,6R)-3,4,5-trihydroxy-6-[[(2R,3S,4S,5R,6R)-3,4,5,6-tetrahydroxyoxan-2-yl]methoxy]oxan-2-yl]methoxycarbothioylamino]butanoic acid;manganese

C85H135MnN7O51S3 — CID 160559940

About [(2S,3R,4S,5S,6S)-2-acetyloxy-4,5-dimethyl-6-[[(2R,3R,4S,5R,6R)-3,4,5-triacetyloxy-6-(hydroxymethyl)oxan-2-yl]oxymethyl]oxan-3-yl] acetate;2-[9-[1-carboxy-3-[[(2R,3S,4S,5R,6R)-3,4,5-trihydroxy-6-[[(2R,3S,4S,5R,6R)-3,4,5,6-tetrahydroxyoxan-2-yl]methoxy]oxan-2-yl]methoxycarbothioylamino]propyl]-6-[3-[[(2R,3S,4S,5R,6R)-3,4,5-trihydroxy-6-[[(2R,3S,4S,5R,6R)-3,4,5,6-tetrahydroxyoxan-2-yl]methoxy]oxan-2-yl]methoxycarbothioylamino]propyl]-3,6,9,15-tetrazabicyclo[9.3.1]pentadeca-1(15),11,13-trien-3-yl]-4-[[(2R,3S,4S,5R,6R)-3,4,5-trihydroxy-6-[[(2R,3S,4S,5R,6R)-3,4,5,6-tetrahydroxyoxan-2-yl]methoxy]oxan-2-yl]methoxycarbothioylamino]butanoic acid;manganese

[(2S,3R,4S,5S,6S)-2-acetyloxy-4,5-dimethyl-6-[[(2R,3R,4S,5R,6R)-3,4,5-triacetyloxy-6-(hydroxymethyl)oxan-2-yl]oxymethyl]oxan-3-yl] acetate;2-[9-[1-carboxy-3-[[(2R,3S,4S,5R,6R)-3,4,5-trihydroxy-6-[[(2R,3S,4S,5R,6R)-3,4,5,6-tetrahydroxyoxan-2-yl]methoxy]oxan-2-yl]methoxycarbothioylamino]propyl]-6-[3-[[(2R,3S,4S,5R,6R)-3,4,5-trihydroxy-6-[[(2R,3S,4S,5R,6R)-3,4,5,6-tetrahydroxyoxan-2-yl]methoxy]oxan-2-yl]methoxycarbothioylamino]propyl]-3,6,9,15-tetrazabicyclo[9.3.1]pentadeca-1(15),11,13-trien-3-yl]-4-[[(2R,3S,4S,5R,6R)-3,4,5-trihydroxy-6-[[(2R,3S,4S,5R,6R)-3,4,5,6-tetrahydroxyoxan-2-yl]methoxy]oxan-2-yl]methoxycarbothioylamino]butanoic acid;manganese (PubChem CID 160559940) has the molecular formula C85H135MnN7O51S3 and a molecular weight of 2222.15 g/mol. Its IUPAC name is [(2S,3R,4S,5S,6S)-2-acetyloxy-4,5-dimethyl-6-[[(2R,3R,4S,5R,6R)-3,4,5-triacetyloxy-6-(hydroxymethyl)oxan-2-yl]oxymethyl]oxan-3-yl] acetate;2-[9-[1-carboxy-3-[[(2R,3S,4S,5R,6R)-3,4,5-trihydroxy-6-[[(2R,3S,4S,5R,6R)-3,4,5,6-tetrahydroxyoxan-2-yl]methoxy]oxan-2-yl]methoxycarbothioylamino]propyl]-6-[3-[[(2R,3S,4S,5R,6R)-3,4,5-trihydroxy-6-[[(2R,3S,4S,5R,6R)-3,4,5,6-tetrahydroxyoxan-2-yl]methoxy]oxan-2-yl]methoxycarbothioylamino]propyl]-3,6,9,15-tetrazabicyclo[9.3.1]pentadeca-1(15),11,13-trien-3-yl]-4-[[(2R,3S,4S,5R,6R)-3,4,5-trihydroxy-6-[[(2R,3S,4S,5R,6R)-3,4,5,6-tetrahydroxyoxan-2-yl]methoxy]oxan-2-yl]methoxycarbothioylamino]butanoic acid;manganese.

Molecular Properties

• Compound Name: [(2S,3R,4S,5S,6S)-2-acetyloxy-4,5-dimethyl-6-[[(2R,3R,4S,5R,6R)-3,4,5-triacetyloxy-6-(hydroxymethyl)oxan-2-yl]oxymethyl]oxan-3-yl] acetate;2-[9-[1-carboxy-3-[[(2R,3S,4S,5R,6R)-3,4,5-trihydroxy-6-[[(2R,3S,4S,5R,6R)-3,4,5,6-tetrahydroxyoxan-2-yl]methoxy]oxan-2-yl]methoxycarbothioylamino]propyl]-6-[3-[[(2R,3S,4S,5R,6R)-3,4,5-trihydroxy-6-[[(2R,3S,4S,5R,6R)-3,4,5,6-tetrahydroxyoxan-2-yl]methoxy]oxan-2-yl]methoxycarbothioylamino]propyl]-3,6,9,15-tetrazabicyclo[9.3.1]pentadeca-1(15),11,13-trien-3-yl]-4-[[(2R,3S,4S,5R,6R)-3,4,5-trihydroxy-6-[[(2R,3S,4S,5R,6R)-3,4,5,6-tetrahydroxyoxan-2-yl]methoxy]oxan-2-yl]methoxycarbothioylamino]butanoic acid;manganese
• PubChem CID: 160559940
• Molecular Formula: C85H135MnN7O51S3
• Molecular Weight: 2222.15 g/mol
• Exact Mass: 2220.67
• IUPAC Name: [(2S,3R,4S,5S,6S)-2-acetyloxy-4,5-dimethyl-6-[[(2R,3R,4S,5R,6R)-3,4,5-triacetyloxy-6-(hydroxymethyl)oxan-2-yl]oxymethyl]oxan-3-yl] acetate;2-[9-[1-carboxy-3-[[(2R,3S,4S,5R,6R)-3,4,5-trihydroxy-6-[[(2R,3S,4S,5R,6R)-3,4,5,6-tetrahydroxyoxan-2-yl]methoxy]oxan-2-yl]methoxycarbothioylamino]propyl]-6-[3-[[(2R,3S,4S,5R,6R)-3,4,5-trihydroxy-6-[[(2R,3S,4S,5R,6R)-3,4,5,6-tetrahydroxyoxan-2-yl]methoxy]oxan-2-yl]methoxycarbothioylamino]propyl]-3,6,9,15-tetrazabicyclo[9.3.1]pentadeca-1(15),11,13-trien-3-yl]-4-[[(2R,3S,4S,5R,6R)-3,4,5-trihydroxy-6-[[(2R,3S,4S,5R,6R)-3,4,5,6-tetrahydroxyoxan-2-yl]methoxy]oxan-2-yl]methoxycarbothioylamino]butanoic acid;manganese
• SMILES: CC(=O)O[C@@H]1O[C@H](CO[C@@H]2O[C@H](CO)[C@@H](OC(C)=O)[C@H](OC(C)=O)[C@H]2OC(C)=O)[C@@H](C)[C@H](C)[C@H]1OC(C)=O.O=C(O)C(CCNC(=S)OC[C@H]1O[C@@H](OC[C@H]2O[C@@H](O)[C@H](O)[C@@H](O)[C@@H]2O)[C@H](O)[C@@H](O)[C@@H]1O)N1CCN(CCCNC(=S)OC[C@H]2O[C@@H](OC[C@H]3O[C@@H](O)[C@H](O)[C@@H](O)[C@@H]3O)[C@H](O)C(O)[C@@H]2O)CCN(C(CCNC(=S)OC[C@H]2O[C@@H](OC[C@H]3O[C@@H](O)[C@H](O)[C@@H](O)[C@@H]3O)[C@H](O)[C@@H](O)[C@@H]2O)C(=O)O)Cc2cccc(n2)C1.[Mn]
• InChI: InChI=1S/C61H99N7O37S3.C24H36O14.Mn/c69-33-27(100-53(91)45(81)39(33)75)17-94-56-48(84)42(78)36(72)30(103-56)20-97-59(106)62-7-2-10-66-11-13-67(25(51(87)88)5-8-63-60(107)98-21-31-37(73)43(79)49(85)57(104-31)95-18-28-34(70)40(76)46(82)54(92)101-28)15-23-3-1-4-24(65-23)16-68(14-12-66)26(52(89)90)6-9-64-61(108)99-22-32-38(74)44(80)50(86)58(105-32)96-19-29-35(71)41(77)47(83)55(93)102-29;1-10-11(2)19(32-12(3)26)24(36-16(7)30)38-18(10)9-31-23-22(35-15(6)29)21(34-14(5)28)20(33-13(4)27)17(8-25)37-23;/h1,3-4,25-50,53-58,69-86,91-93H,2,5-22H2,(H,62,106)(H,63,107)(H,64,108)(H,87,88)(H,89,90);10-11,17-25H,8-9H2,1-7H3;/t25?,26?,27-,28-,29-,30-,31-,32-,33-,34-,35-,36-,37-,38-,39+,40+,41+,42?,43+,44+,45-,46-,47-,48-,49-,50-,53-,54-,55-,56-,57-,58-;10-,11-,17+,18+,19+,20+,21-,22+,23+,24+;/m10./s1
• InChIKey: UZIOUZXYSKZGHP-KBDIVXRTSA-N
• XLogP: -14.37
• TPSA: 848.31 Ų
• H-Bond Donors: 27
• H-Bond Acceptors: 56
• Rotatable Bonds: 38
• Heavy Atoms: 147
• Complexity: —

Lipinski Rule of Five

3 violations

Rule	Value
MW ≤ 500	2222.15
LogP ≤ 5	-14.37
H-Bond Donors ≤ 5	27
H-Bond Acceptors ≤ 10	56

Computed Properties (RDKit)

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

Frequently Asked Questions

What is the IUPAC name of [(2S,3R,4S,5S,6S)-2-acetyloxy-4,5-dimethyl-6-[[(2R,3R,4S,5R,6R)-3,4,5-triacetyloxy-6-(hydroxymethyl)oxan-2-yl]oxymethyl]oxan-3-yl] acetate;2-[9-[1-carboxy-3-[[(2R,3S,4S,5R,6R)-3,4,5-trihydroxy-6-[[(2R,3S,4S,5R,6R)-3,4,5,6-tetrahydroxyoxan-2-yl]methoxy]oxan-2-yl]methoxycarbothioylamino]propyl]-6-[3-[[(2R,3S,4S,5R,6R)-3,4,5-trihydroxy-6-[[(2R,3S,4S,5R,6R)-3,4,5,6-tetrahydroxyoxan-2-yl]methoxy]oxan-2-yl]methoxycarbothioylamino]propyl]-3,6,9,15-tetrazabicyclo[9.3.1]pentadeca-1(15),11,13-trien-3-yl]-4-[[(2R,3S,4S,5R,6R)-3,4,5-trihydroxy-6-[[(2R,3S,4S,5R,6R)-3,4,5,6-tetrahydroxyoxan-2-yl]methoxy]oxan-2-yl]methoxycarbothioylamino]butanoic acid;manganese?

The IUPAC name of [(2S,3R,4S,5S,6S)-2-acetyloxy-4,5-dimethyl-6-[[(2R,3R,4S,5R,6R)-3,4,5-triacetyloxy-6-(hydroxymethyl)oxan-2-yl]oxymethyl]oxan-3-yl] acetate;2-[9-[1-carboxy-3-[[(2R,3S,4S,5R,6R)-3,4,5-trihydroxy-6-[[(2R,3S,4S,5R,6R)-3,4,5,6-tetrahydroxyoxan-2-yl]methoxy]oxan-2-yl]methoxycarbothioylamino]propyl]-6-[3-[[(2R,3S,4S,5R,6R)-3,4,5-trihydroxy-6-[[(2R,3S,4S,5R,6R)-3,4,5,6-tetrahydroxyoxan-2-yl]methoxy]oxan-2-yl]methoxycarbothioylamino]propyl]-3,6,9,15-tetrazabicyclo[9.3.1]pentadeca-1(15),11,13-trien-3-yl]-4-[[(2R,3S,4S,5R,6R)-3,4,5-trihydroxy-6-[[(2R,3S,4S,5R,6R)-3,4,5,6-tetrahydroxyoxan-2-yl]methoxy]oxan-2-yl]methoxycarbothioylamino]butanoic acid;manganese (CID 160559940) is [(2S,3R,4S,5S,6S)-2-acetyloxy-4,5-dimethyl-6-[[(2R,3R,4S,5R,6R)-3,4,5-triacetyloxy-6-(hydroxymethyl)oxan-2-yl]oxymethyl]oxan-3-yl] acetate;2-[9-[1-carboxy-3-[[(2R,3S,4S,5R,6R)-3,4,5-trihydroxy-6-[[(2R,3S,4S,5R,6R)-3,4,5,6-tetrahydroxyoxan-2-yl]methoxy]oxan-2-yl]methoxycarbothioylamino]propyl]-6-[3-[[(2R,3S,4S,5R,6R)-3,4,5-trihydroxy-6-[[(2R,3S,4S,5R,6R)-3,4,5,6-tetrahydroxyoxan-2-yl]methoxy]oxan-2-yl]methoxycarbothioylamino]propyl]-3,6,9,15-tetrazabicyclo[9.3.1]pentadeca-1(15),11,13-trien-3-yl]-4-[[(2R,3S,4S,5R,6R)-3,4,5-trihydroxy-6-[[(2R,3S,4S,5R,6R)-3,4,5,6-tetrahydroxyoxan-2-yl]methoxy]oxan-2-yl]methoxycarbothioylamino]butanoic acid;manganese.

What is the SMILES notation for [(2S,3R,4S,5S,6S)-2-acetyloxy-4,5-dimethyl-6-[[(2R,3R,4S,5R,6R)-3,4,5-triacetyloxy-6-(hydroxymethyl)oxan-2-yl]oxymethyl]oxan-3-yl] acetate;2-[9-[1-carboxy-3-[[(2R,3S,4S,5R,6R)-3,4,5-trihydroxy-6-[[(2R,3S,4S,5R,6R)-3,4,5,6-tetrahydroxyoxan-2-yl]methoxy]oxan-2-yl]methoxycarbothioylamino]propyl]-6-[3-[[(2R,3S,4S,5R,6R)-3,4,5-trihydroxy-6-[[(2R,3S,4S,5R,6R)-3,4,5,6-tetrahydroxyoxan-2-yl]methoxy]oxan-2-yl]methoxycarbothioylamino]propyl]-3,6,9,15-tetrazabicyclo[9.3.1]pentadeca-1(15),11,13-trien-3-yl]-4-[[(2R,3S,4S,5R,6R)-3,4,5-trihydroxy-6-[[(2R,3S,4S,5R,6R)-3,4,5,6-tetrahydroxyoxan-2-yl]methoxy]oxan-2-yl]methoxycarbothioylamino]butanoic acid;manganese?

The canonical SMILES for [(2S,3R,4S,5S,6S)-2-acetyloxy-4,5-dimethyl-6-[[(2R,3R,4S,5R,6R)-3,4,5-triacetyloxy-6-(hydroxymethyl)oxan-2-yl]oxymethyl]oxan-3-yl] acetate;2-[9-[1-carboxy-3-[[(2R,3S,4S,5R,6R)-3,4,5-trihydroxy-6-[[(2R,3S,4S,5R,6R)-3,4,5,6-tetrahydroxyoxan-2-yl]methoxy]oxan-2-yl]methoxycarbothioylamino]propyl]-6-[3-[[(2R,3S,4S,5R,6R)-3,4,5-trihydroxy-6-[[(2R,3S,4S,5R,6R)-3,4,5,6-tetrahydroxyoxan-2-yl]methoxy]oxan-2-yl]methoxycarbothioylamino]propyl]-3,6,9,15-tetrazabicyclo[9.3.1]pentadeca-1(15),11,13-trien-3-yl]-4-[[(2R,3S,4S,5R,6R)-3,4,5-trihydroxy-6-[[(2R,3S,4S,5R,6R)-3,4,5,6-tetrahydroxyoxan-2-yl]methoxy]oxan-2-yl]methoxycarbothioylamino]butanoic acid;manganese is CC(=O)O[C@@H]1O[C@H](CO[C@@H]2O[C@H](CO)[C@@H](OC(C)=O)[C@H](OC(C)=O)[C@H]2OC(C)=O)[C@@H](C)[C@H](C)[C@H]1OC(C)=O.O=C(O)C(CCNC(=S)OC[C@H]1O[C@@H](OC[C@H]2O[C@@H](O)[C@H](O)[C@@H](O)[C@@H]2O)[C@H](O)[C@@H](O)[C@@H]1O)N1CCN(CCCNC(=S)OC[C@H]2O[C@@H](OC[C@H]3O[C@@H](O)[C@H](O)[C@@H](O)[C@@H]3O)[C@H](O)C(O)[C@@H]2O)CCN(C(CCNC(=S)OC[C@H]2O[C@@H](OC[C@H]3O[C@@H](O)[C@H](O)[C@@H](O)[C@@H]3O)[C@H](O)[C@@H](O)[C@@H]2O)C(=O)O)Cc2cccc(n2)C1.[Mn].

What is the InChIKey of [(2S,3R,4S,5S,6S)-2-acetyloxy-4,5-dimethyl-6-[[(2R,3R,4S,5R,6R)-3,4,5-triacetyloxy-6-(hydroxymethyl)oxan-2-yl]oxymethyl]oxan-3-yl] acetate;2-[9-[1-carboxy-3-[[(2R,3S,4S,5R,6R)-3,4,5-trihydroxy-6-[[(2R,3S,4S,5R,6R)-3,4,5,6-tetrahydroxyoxan-2-yl]methoxy]oxan-2-yl]methoxycarbothioylamino]propyl]-6-[3-[[(2R,3S,4S,5R,6R)-3,4,5-trihydroxy-6-[[(2R,3S,4S,5R,6R)-3,4,5,6-tetrahydroxyoxan-2-yl]methoxy]oxan-2-yl]methoxycarbothioylamino]propyl]-3,6,9,15-tetrazabicyclo[9.3.1]pentadeca-1(15),11,13-trien-3-yl]-4-[[(2R,3S,4S,5R,6R)-3,4,5-trihydroxy-6-[[(2R,3S,4S,5R,6R)-3,4,5,6-tetrahydroxyoxan-2-yl]methoxy]oxan-2-yl]methoxycarbothioylamino]butanoic acid;manganese?

The InChIKey is UZIOUZXYSKZGHP-KBDIVXRTSA-N. The full InChI is InChI=1S/C61H99N7O37S3.C24H36O14.Mn/c69-33-27(100-53(91)45(81)39(33)75)17-94-56-48(84)42(78)36(72)30(103-56)20-97-59(106)62-7-2-10-66-11-13-67(25(51(87)88)5-8-63-60(107)98-21-31-37(73)43(79)49(85)57(104-31)95-18-28-34(70)40(76)46(82)54(92)101-28)15-23-3-1-4-24(65-23)16-68(14-12-66)26(52(89)90)6-9-64-61(108)99-22-32-38(74)44(80)50(86)58(105-32)96-19-29-35(71)41(77)47(83)55(93)102-29;1-10-11(2)19(32-12(3)26)24(36-16(7)30)38-18(10)9-31-23-22(35-15(6)29)21(34-14(5)28)20(33-13(4)27)17(8-25)37-23;/h1,3-4,25-50,53-58,69-86,91-93H,2,5-22H2,(H,62,106)(H,63,107)(H,64,108)(H,87,88)(H,89,90);10-11,17-25H,8-9H2,1-7H3;/t25?,26?,27-,28-,29-,30-,31-,32-,33-,34-,35-,36-,37-,38-,39+,40+,41+,42?,43+,44+,45-,46-,47-,48-,49-,50-,53-,54-,55-,56-,57-,58-;10-,11-,17+,18+,19+,20+,21-,22+,23+,24+;/m10./s1.

What are the key properties of [(2S,3R,4S,5S,6S)-2-acetyloxy-4,5-dimethyl-6-[[(2R,3R,4S,5R,6R)-3,4,5-triacetyloxy-6-(hydroxymethyl)oxan-2-yl]oxymethyl]oxan-3-yl] acetate;2-[9-[1-carboxy-3-[[(2R,3S,4S,5R,6R)-3,4,5-trihydroxy-6-[[(2R,3S,4S,5R,6R)-3,4,5,6-tetrahydroxyoxan-2-yl]methoxy]oxan-2-yl]methoxycarbothioylamino]propyl]-6-[3-[[(2R,3S,4S,5R,6R)-3,4,5-trihydroxy-6-[[(2R,3S,4S,5R,6R)-3,4,5,6-tetrahydroxyoxan-2-yl]methoxy]oxan-2-yl]methoxycarbothioylamino]propyl]-3,6,9,15-tetrazabicyclo[9.3.1]pentadeca-1(15),11,13-trien-3-yl]-4-[[(2R,3S,4S,5R,6R)-3,4,5-trihydroxy-6-[[(2R,3S,4S,5R,6R)-3,4,5,6-tetrahydroxyoxan-2-yl]methoxy]oxan-2-yl]methoxycarbothioylamino]butanoic acid;manganese?

[(2S,3R,4S,5S,6S)-2-acetyloxy-4,5-dimethyl-6-[[(2R,3R,4S,5R,6R)-3,4,5-triacetyloxy-6-(hydroxymethyl)oxan-2-yl]oxymethyl]oxan-3-yl] acetate;2-[9-[1-carboxy-3-[[(2R,3S,4S,5R,6R)-3,4,5-trihydroxy-6-[[(2R,3S,4S,5R,6R)-3,4,5,6-tetrahydroxyoxan-2-yl]methoxy]oxan-2-yl]methoxycarbothioylamino]propyl]-6-[3-[[(2R,3S,4S,5R,6R)-3,4,5-trihydroxy-6-[[(2R,3S,4S,5R,6R)-3,4,5,6-tetrahydroxyoxan-2-yl]methoxy]oxan-2-yl]methoxycarbothioylamino]propyl]-3,6,9,15-tetrazabicyclo[9.3.1]pentadeca-1(15),11,13-trien-3-yl]-4-[[(2R,3S,4S,5R,6R)-3,4,5-trihydroxy-6-[[(2R,3S,4S,5R,6R)-3,4,5,6-tetrahydroxyoxan-2-yl]methoxy]oxan-2-yl]methoxycarbothioylamino]butanoic acid;manganese has a molecular weight of 2222.15 g/mol, XLogP of -14.37, 38 rotatable bonds, 27 hydrogen bond donors, and 56 hydrogen bond acceptors.

Where does this data come from?

All data for [(2S,3R,4S,5S,6S)-2-acetyloxy-4,5-dimethyl-6-[[(2R,3R,4S,5R,6R)-3,4,5-triacetyloxy-6-(hydroxymethyl)oxan-2-yl]oxymethyl]oxan-3-yl] acetate;2-[9-[1-carboxy-3-[[(2R,3S,4S,5R,6R)-3,4,5-trihydroxy-6-[[(2R,3S,4S,5R,6R)-3,4,5,6-tetrahydroxyoxan-2-yl]methoxy]oxan-2-yl]methoxycarbothioylamino]propyl]-6-[3-[[(2R,3S,4S,5R,6R)-3,4,5-trihydroxy-6-[[(2R,3S,4S,5R,6R)-3,4,5,6-tetrahydroxyoxan-2-yl]methoxy]oxan-2-yl]methoxycarbothioylamino]propyl]-3,6,9,15-tetrazabicyclo[9.3.1]pentadeca-1(15),11,13-trien-3-yl]-4-[[(2R,3S,4S,5R,6R)-3,4,5-trihydroxy-6-[[(2R,3S,4S,5R,6R)-3,4,5,6-tetrahydroxyoxan-2-yl]methoxy]oxan-2-yl]methoxycarbothioylamino]butanoic acid;manganese is sourced from PubChem (CID 160559940), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).