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Substance Name: Methyl 5-oxo-L-prolinate, compound with amphotericin B (1:1)
RN: 64358-73-2
InChIKey: RXVIITZZNPXTBI-LAQSJDTQSA-N

Molecular Formula

  • C48-H75-N-O17.C5-H7-N-O3

Molecular Weight

  • 1067.2248
 
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Names and Synonyms

Synonym

  • EINECS 264-841-7

Systematic Name

  • Methyl 5-oxo-L-prolinate, compound with amphotericin B (1:1)

Registry Numbers

CAS Registry Number

  • 64358-73-2

System Generated Number

  • 0064358732

Molecular Formulas

Molecular Formula

  • C48-H75-N-O17.C5-H7-N-O3

Molecular Formula Fragments

  • C48-H75-N-O17
  • C5-H7-N-O3
  • COMPONENT

Structure Descriptors

InChI

1S/C47H73NO17.C6H9NO3/c1-27-17-15-13-11-9-7-5-6-8-10-12-14-16-18-34(64-46-44(58)41(48)43(57)30(4)63-46)24-38-40(45(59)60)37(54)26-47(61,65-38)25-33(51)22-36(53)35(52)20-19-31(49)21-32(50)23-39(55)62-29(3)28(2)42(27)56;1-10-6(9)4-2-3-5(8)7-4/h5-18,27-38,40-44,46,49-54,56-58,61H,19-26,48H2,1-4H3,(H,59,60);4H,2-3H2,1H3,(H,7,8)/b6-5+,9-7+,10-8+,13-11+,14-12+,17-15+,18-16+;/t27?,28-,29-,30+,31+,32+,33-,34-,35+,36+,37-,38-,40?,41-,42+,43+,44-,46-,47+;4-/m00/s1

InChIKey

RXVIITZZNPXTBI-LAQSJDTQSA-N

Smiles

C[C@H]1[C@@H](OC(=O)C[C@@H](C[C@@H](CC[C@H]([C@@H](C[C@@H](CC2(C[C@@H](C([C@@H](O2)C[C@H](/C=C/C=C/C=C/C=C/C=C/C=C/C=C/C([C@H]1O)C)O[C@H]3[C@H]([C@H]([C@@H]([C@H](O3)C)O)N)O)C(=O)O)O)O)O)O)O)O)O)C.COC(=O)[C@@H]1CCC(=O)N1