Skip Navigation
ChemIDplus A TOXNET DATABASE LiteBrowseAdvanced

Substance Name: Octacyclomycin
RN: 98824-17-0
InChIKey: KNFNZSMXPGQAER-UHFFFAOYSA-N

Note

  • Isolated from Streptomyces.

Molecular Formula

  • C52-H88-O19

Molecular Weight

  • 1017.25
 
* denotes mobile formatted website

Links to Resources

NLM Resources (File Locators)

Other Resources (Internet Locators)


Search for this InChIKey on the Web

Names and Synonyms

Name of Substance

  • Octacyclomycin

Systematic Name

  • Semduramicin, 30-hydroxy-5-(tetrahydro-5-methoxy-6-methyl-2H-pyran-2-yl)-

Registry Numbers

CAS Registry Number

  • 98824-17-0

System Generated Number

  • 0098824170

Structure Descriptors

InChI

1S/C52H88O19/c1-26-21-27(2)52(58,25-53)69-42(26)36-22-37(64-40-15-13-34(59-10)31(6)62-40)47(65-36)49(9)18-17-38(67-49)48(8)19-20-50(71-48)23-33(54)28(3)43(68-50)29(4)44-46(61-12)45(30(5)51(57,70-44)24-39(55)56)66-41-16-14-35(60-11)32(7)63-41/h26-38,40-47,53-54,57-58H,13-25H2,1-12H3,(H,55,56)

InChIKey

KNFNZSMXPGQAER-UHFFFAOYSA-N

Smiles

C1C[C@@]([C@@H]2O[C@@](CC2)([C@@H]2[C@@H](C[C@@H](O2)[C@@H]2[C@@H](C[C@@H]([C@@](O2)(CO)O)C)C)O[C@@H]2O[C@@H]([C@@H](CC2)OC)C)C)(C)O[C@@]21O[C@@H]([C@@H]([C@@H]1O[C@@]([C@@H](C)[C@@H]([C@@H]1OC)O[C@@H]1CC[C@@H]([C@@H](O1)C)OC)(CC(=O)O)O)C)[C@@H]([C@@H](C2)O)C