Skip Navigation
ChemIDplus A TOXNET DATABASE LiteBrowseAdvanced

Substance Name: Roridin A
RN: 14729-29-4
UNII: U28899D1U2
InChIKey: NSFWWJIQIKBZMJ-PAGWOCKZSA-N

Note

  • See also records for roridin C, D, E & J.

Classification Codes

  • Drug / Therapeutic Agent
  • Skin / Eye Irritant

Molecular Formula

  • C29-H40-O9

Molecular Weight

  • 532.626
 
* denotes mobile formatted website

Links to Resources


Search for this InChIKey on the Web

Names and Synonyms

Name of Substance

  • Roridin A

Synonyms

  • AI3-29708
  • EINECS 238-783-8
  • NSC 200737
  • Roridan A
  • Roridin A
  • Roridine A
  • UNII-U28899D1U2

Systematic Names

  • Roridin A
  • Verrucarin A, 7'-deoxo-7'-((1R)-1-hydroxyethyl)-, (7'R)-
  • Verrucarin A, 7'-deoxo-7'-(1-hydroxyethyl)-
  • Verrucarin A, 7'-deoxo-7'-(1-hydroxyethyl)-, (7'R(R))-

Registry Numbers

CAS Registry Number

  • 14729-29-4

FDA UNII

  • U28899D1U2

System Generated Number

  • 0014729294

Structure Descriptors

InChI

1S/C29H40O9/c1-17-9-11-28-15-35-26(33)25(32)18(2)10-12-34-20(19(3)30)7-5-6-8-24(31)38-21-14-23(37-22(28)13-17)29(16-36-29)27(21,28)4/h5-8,13,18-23,25,30,32H,9-12,14-16H2,1-4H3/b7-5+,8-6-/t18-,19-,20-,21-,22-,23-,25+,27-,28-,29+/m1/s1

InChIKey

NSFWWJIQIKBZMJ-PAGWOCKZSA-N

Smiles

C[C@@H](O)[C@@H]1OCC[C@@H](C)[C@H](O)C(=O)OC[C@]23CCC(=C[C@H]2O[C@@H]4C[C@@H](OC(=O)\C=C/C=C/1)[C@@]3(C)[C@]45CO5)C

Toxicity

Organism Test Type Route Reported Dose (Normalized Dose) Effect Source
mouse LD50 intraperitoneal 500ug/kg (0.5mg/kg)   Developments in Food Science. Vol. 4, Pg. 135, 1983.
mouse LD50 intravenous 1mg/kg (1mg/kg)   Biotechnology and Bioengineering. Vol. 10, Pg. 445, 1968.
mouse LD50 oral 9mg/kg (9mg/kg) BEHAVIORAL: CONVULSIONS OR EFFECT ON SEIZURE THRESHOLD

BEHAVIORAL: MUSCLE CONTRACTION OR SPASTICITY)

BEHAVIORAL: SOMNOLENCE (GENERAL DEPRESSED ACTIVITY)
Toxicon. Vol. 23, Pg. 731, 1985.
rabbit LDLo oral 2300ug/kg (2.3mg/kg) GASTROINTESTINAL: "HYPERMOTILITY, DIARRHEA"

GASTROINTESTINAL: ULCERATION OR BLEEDING FROM LARGE INTESTINE
Toxicon. Vol. 23, Pg. 731, 1985.