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Substance Name: Octacosamicin B
RN: 122005-24-7
InChIKey: YRBWJHGUKBSDDE-RLZHPBLRSA-N

Note

  • From Amycolatopsis.

Classification Codes

  • Drug / Therapeutic Agent
  • Natural Product

Molecular Formula

  • C32-H54-N4-O9

Molecular Weight

  • 638.798
 
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Names and Synonyms

Name of Substance

  • Octacosamicin B

Systematic Name

  • Octacosamicin B

Registry Numbers

CAS Registry Number

  • 122005-24-7

Other Registry Number

  • 120527-86-8

System Generated Number

  • 0122005247

Structure Descriptors

InChI

1S/C32H54N4O9/c1-24(27(39)21-26(38)22-28(40)30(43)31(44)35-23-29(41)42)17-13-9-5-2-3-6-10-14-18-25(37)19-15-11-7-4-8-12-16-20-36(45)32(33)34/h2-3,5-7,11,15,19,24,26-28,30,38-40,43,45H,4,8-10,12-14,16-18,20-23H2,1H3,(H3,33,34)(H,35,44)(H,41,42)/b5-2+,6-3+,11-7+,19-15+

InChIKey

YRBWJHGUKBSDDE-RLZHPBLRSA-N

Smiles

C(CNC([C@@H]([C@@H](C[C@@H](C[C@@H]([C@@H](CCC\C=C\C=C\CCCC(\C=C\C=C\CCCCCN(O)C(=N)N)=O)C)O)O)O)O)=O)(=O)O