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Substance Name: Antibiotic A-32887
ID: CB91540000
InChIKey: UJIHDADJTABBLP-KZXQFLGRSA-N

Classification Codes

  • Drug / Therapeutic Agent
  • Natural Product

Molecular Formula

  • C48-H82-O18.K.Na

Molecular Weight

  • 1009.2458
 
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Names and Synonyms

Synonym

  • A-32887

Systematic Name

  • Antibiotic A-32887

Registry Numbers

ID Number

  • NIOSH/CB9154000

System Generated Number

  • CB91540000

Molecular Formulas

Molecular Formula

  • C48-H82-O18.K.Na

Molecular Formula Fragments

  • C48-H82-O18
  • COMPONENT
  • K
  • Na

Structure Descriptors

InChI

1S/C48H82O18.K.Na/c1-23-38(62-37-20-18-30(54-10)28(6)59-37)25(3)46(9,52)65-39(23)33-16-15-31(60-33)32-17-19-35(61-32)45(8)42(57-13)27(5)48(66-45)24(2)34(55-11)21-29(63-48)22-36-44(7,58-14)41(56-12)26(4)47(53,64-36)40(49)43(50)51;;/h23-42,49,52-53H,15-22H2,1-14H3,(H,50,51);;/q;2*+1/t23-,24+,25+,26-,27+,28+,29-,30-,31+,32-,33+,34+,35+,36-,37-,38?,39-,40-,41-,42+,44-,45+,46-,47-,48-;;/m0../s1

InChIKey

UJIHDADJTABBLP-KZXQFLGRSA-N

Smiles

[Na+].[K+].CO[C@H]1CC[C@H](OC2[C@H](C)[C@H](O[C@](C)(O)[C@@H]2C)[C@H]3CC[C@@H](O3)[C@@H]4CC[C@@H](O4)[C@@]5(C)O[C@]6(O[C@H](C[C@@H]7O[C@](O)([C@@H](O)C(=O)O)[C@@H](C)[C@H](OC)[C@@]7(C)OC)C[C@@H](OC)[C@H]6C)[C@H](C)[C@H]5OC)O[C@@H]1C