Skip Navigation
ChemIDplus A TOXNET DATABASE LiteBrowseAdvanced

Substance Name: 7-Hexyloxy-7-demethoxymitomycin A
RN: 56981-78-3
InChIKey: QUTHQTJGEPOWFZ-QHLODZMVSA-N

Classification Code

  • Drug / Therapeutic Agent

Molecular Formula

  • C21-H29-N3-O6

Molecular Weight

  • 419.475
 
* 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

Results Name

  • 7-Hexyloxy-7-demethoxymitomycin A

Synonyms

  • 7-Hexyloxy-7-demethoxymitomycin A
  • 7-Hexyloxy-9-(hydroxymethyl)-9a-methoxy-6-methylmitosane carbamate

Systematic Name

  • Azirino(2',3':3,4)pyrrolo(1,2-a)indole-4,7-dione, 1,1a,2,8,8a,8b-hexahydro-6-hexyloxy-8-(hydroxymethyl)-8a-methoxy-5-methyl-, carbamate

Registry Numbers

CAS Registry Number

  • 56981-78-3

System Generated Number

  • 0056981783

Structure Descriptors

InChI

1S/C21H29N3O6/c1-4-5-6-7-8-29-18-11(2)16(25)15-14(17(18)26)12(10-30-20(22)27)21(28-3)19-13(23-19)9-24(15)21/h12-13,19,23H,4-10H2,1-3H3,(H2,22,27)/t12-,13?,19?,21-/m1/s1

InChIKey

QUTHQTJGEPOWFZ-QHLODZMVSA-N

Smiles

N12[C@@]([C@@H](C=3C(C(OCCCCCC)=C(C(C13)=O)C)=O)COC(N)=O)([C@@H]1[C@@H](C2)N1)OC

Toxicity

Organism Test Type Route Reported Dose (Normalized Dose) Effect Source
mouse LD50 intraperitoneal 23mg/kg (23mg/kg)   Journal of Antibiotics. Vol. 33, Pg. 804, 1980.