Skip Navigation
ChemIDplus A TOXNET DATABASE LiteBrowseAdvanced

Substance Name: Arugomycin, de(3-carboxy-1-oxo-2-propenyl)-
RN: 99552-19-9
InChIKey: BEYIUMNWZFAGQA-UHFFFAOYSA-N

Classification Code

  • Mutation Data

Molecular Formula

  • C76-H110-N2-O34

Molecular Weight

  • 1595.685
 
* 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

Synonym

  • De(3-carboxy-1-oxo-2-propenyl)arugomycin

Systematic Names

  • 2,6-Epoxy-2H-naphthaceno(1,2-b)oxocin, arugomycin deriv. (9CI)
  • Arugomycin, de(3-carboxy-1-oxo-2-propenyl)-

Registry Numbers

CAS Registry Number

  • 99552-19-9

System Generated Number

  • 0099552199

Structure Descriptors

InChI

1S/C76H110N2O34/c1-28-59(82)41(92-13)22-49(97-28)107-68-33(6)102-50(25-44(68)95-16)105-65-30(3)99-46(20-39(65)80)106-67-32(5)101-48(24-43(67)94-15)104-45-26-75(9,89)57(72(88)96-17)35-18-36-54(62(85)53(35)45)63(86)55-38(79)19-37-69(56(55)61(36)84)111-73-64(87)58(77(11)12)71(76(37,10)112-73)110-47-21-40(81)66(31(4)100-47)108-52-27-74(8,78(90)91)70(34(7)103-52)109-51-23-42(93-14)60(83)29(2)98-51/h18-19,28-34,39-52,57-60,64-68,70-71,73,79-83,85,87,89H,20-27H2,1-17H3

InChIKey

BEYIUMNWZFAGQA-UHFFFAOYSA-N

Smiles

CC1C(C(CC(O1)OC2C(OC(CC2OC)OC3C(OC(CC3O)OC4C(OC(CC4OC)OC5CC(C(c6c5c(c7c(c6)C(=O)c8c(c(cc9c8OC1C(C(C(C9(O1)C)OC1CC(C(C(O1)C)OC1CC(C(C(O1)C)OC1CC(C(C(O1)C)O)OC)(C)[N+](=O)[O-])O)N(C)C)O)O)C7=O)O)C(=O)OC)(C)O)C)C)C)OC)O