Skip Navigation
ChemIDplus A TOXNET DATABASE LiteBrowseAdvanced

Substance Name: 2-Oxo-6-dehydroxyneoanisatin
RN: 128129-58-8
InChIKey: PKSKJUUWVGTFQJ-YLJFTQHESA-N

Note

  • From the pericarps of Illicium majus.

Classification Code

  • Natural Product

Molecular Formula

  • C15-H18-O7

Molecular Weight

  • 310.3
 
* 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

  • 2-Oxo-6-dehydroxyneoanisatin

Synonym

  • 2-Oxo-6-dehydroxyneoanisatin deriv.

Systematic Name

  • Spiro(6H-4,9a-methanocyclopent(d)oxocin-6,3'-oxetane)-2,2'8(1H,9H)-trione, tetrahydro-1,6a-dihydroxy-5,9-dimethyl-, (1R-(1-alpha,4-beta,5-alpha,6-beta,6a-beta,9-alpha,9a-beta))-

Registry Numbers

CAS Registry Number

  • 128129-58-8

System Generated Number

  • 0128129588

Structure Descriptors

InChI

1S/C15H18O7/c1-6-8(16)3-15(20)13(6)4-9(22-11(18)10(13)17)7(2)14(15)5-21-12(14)19/h6-7,9-10,17,20H,3-5H2,1-2H3/t6-,7-,9-,10-,13?,14?,15-/m0/s1

InChIKey

PKSKJUUWVGTFQJ-YLJFTQHESA-N

Smiles

O1C([C@@H]([C@@]23[C@@]([C@@]4([C@H]([C@H]1C3)C)C(OC4)=O)(CC([C@@H]2C)=O)O)O)=O

Toxicity

Organism Test Type Route Reported Dose (Normalized Dose) Effect Source
mouse LD50 unreported 1464ug/kg (1.464mg/kg) BEHAVIORAL: CONVULSIONS OR EFFECT ON SEIZURE THRESHOLD Chemical and Pharmaceutical Bulletin. Vol. 38, Pg. 291, 1990.