Skip Navigation
ChemIDplus A TOXNET DATABASE LiteBrowseAdvanced

Substance Name: Diacetoxyscirpenol
RN: 2270-40-8
UNII: UYL28I099N
InChIKey: AUGQEEXBDZWUJY-NMAPUUFXSA-N

Note

  • Mycotoxin belonging to 12,13-epoxytrichothecene group.

Molecular Formula

  • C19-H26-O7

Molecular Weight

  • 366.4074
 

Classification Codes

  • Antineoplastic Agents
  • Human Data
  • Mutation Data
  • Natural Product
  • Reproductive Effect
  • Skin / Eye Irritant
* denotes mobile formatted website

Links to Resources


Search for this InChIKey on the Web

Names and Synonyms

Name of Substance

  • Diacetoxyscirpenol

Synonyms

  • 3-alpha-Hydroxy-4-beta,15-diacetoxy-12,13-epoxytrichothec-9-ene
  • 4,15-Di-O-acetylscirpenol
  • 4,15-Diacetoxyscirp-9-en-3-ol
  • 4,15-Diacetoxyscirpen-3-ol
  • 4,15-Diacetoxyscirpenol
  • 4beta,15-Diacetoxy-3alpha-hydroxy-12,13-epoxytrichothec-9-ene
  • ANG 66
  • Anguidin
  • Anguidine
  • CCRIS 3536
  • DAS
  • Diacetoxyscirpenol
  • Diazetoxyskirpenol
  • Diazetoxyskirpenol [German]
  • EINECS 218-873-3
  • HSDB 7244
  • MM 4462
  • NSC 141537
  • NSC-141537
  • Scirp-9-ene-3alpha,4beta,15-triol, 4,15-diacetate
  • Scirpenetriol 4,15-diacetate
  • Trichothec-9-ene, 12,13-epoxy-4beta,15-diazetoxy-3alpha-hydroxy-
  • Trichothec-9-ene-3,4,15-triol, 12,13-epoxy-, 4,15-diacetate
  • UNII-UYL28I099N

Systematic Names

  • 12,13-Epoxytrichothec-9-ene-3alpha,4beta,15-triol 4,15-diacetate
  • Anguidine
  • Trichothec-9-3n3-3,4,15-triol, 12,13-epoxy-, 4,15-diacetate, (3alpha,4beta)-
  • Trichothec-9-ene-3alpha,4beta,15-triol, 12,13-epoxy-, 4,15-diacetate

Registry Numbers

CAS Registry Number

  • 2270-40-8

FDA UNII

  • UYL28I099N

Other Registry Numbers

  • 109547-11-7
  • 11011-10-2
  • 145427-91-4
  • 22135-66-6
  • 25662-95-7
  • 28776-47-8

System Generated Number

  • 0002270408

Structure Descriptors

InChI

1S/C19H26O7/c1-10-5-6-18(8-23-11(2)20)13(7-10)26-16-14(22)15(25-12(3)21)17(18,4)19(16)9-24-19/h7,13-16,22H,5-6,8-9H2,1-4H3/t13-,14-,15-,16-,17-,18-,19+/m1/s1

InChIKey

AUGQEEXBDZWUJY-NMAPUUFXSA-N

Smiles

CC1=C[C@@H]2[C@](CC1)([C@]3([C@@H]([C@H]([C@H]([C@@]34CO4)O2)O)OC(=O)C)C)COC(=O)C

Toxicity

Organism Test Type Route Reported Dose (Normalized Dose) Effect Source
chicken LD50 oral 3820ug/kg (3.82mg/kg) BEHAVIORAL: MUSCLE WEAKNESS

GASTROINTESTINAL: "HYPERMOTILITY, DIARRHEA"
Applied and Environmental Microbiology. Vol. 35, Pg. 636, 1978.
dog LD50 intravenous 1100ug/kg (1.1mg/kg) CARDIAC: PULSE RATE

LUNGS, THORAX, OR RESPIRATION: CYANOSIS

SKIN AND APPENDAGES (SKIN): "DERMATITIS, ALLERGIC: AFTER TOPICAL EXPOSURE"
Arzneimittel-Forschung. Drug Research. Vol. 18, Pg. 989, 1968.
guinea pig LD50 intravenous 1mg/kg (1mg/kg)   Veterinary and Human Toxicology. Vol. 25, Pg. 335, 1983.
guinea pig LD50 oral 2140ug/kg (2.14mg/kg) GASTROINTESTINAL: ULCERATION OR BLEEDING FROM STOMACH Zentralblatt fuer Veterinaermedizin, Reihe A. Vol. 28, Pg. 165, 1981.
mouse LC50 inhalation 11300ug/kg (11.3mg/kg) LUNGS, THORAX, OR RESPIRATION: STRUCTURAL OR FUNCTIONAL CHANGE IN TRACHEA OR BRONCHI

GASTROINTESTINAL: ULCERATION OR BLEEDING FROM SMALL INTESTINE
Toxicologist. Vol. 4, Pg. 12, 1984.
mouse LD50 intraperitoneal 7839ug/kg (7.839mg/kg)   National Cancer Institute Screening Program Data Summary, Developmental Therapeutics Program. Vol. JAN1986,
mouse LD50 intravenous 7762ug/kg (7.762mg/kg)   National Cancer Institute Screening Program Data Summary, Developmental Therapeutics Program. Vol. JAN1986,
mouse LD50 oral 7300ug/kg (7.3mg/kg)   Biotechnology and Bioengineering. Vol. 10, Pg. 445, 1968.
mouse LD50 subcutaneous 7709ug/kg (7.709mg/kg)   National Cancer Institute Screening Program Data Summary, Developmental Therapeutics Program. Vol. JAN1986,
pig LD50 intravenous 300ug/kg (0.3mg/kg)   Veterinary and Human Toxicology. Vol. 25, Pg. 335, 1983.
rabbit LD50 intravenous 1mg/kg (1mg/kg) SKIN AND APPENDAGES (SKIN): "DERMATITIS, ALLERGIC: AFTER TOPICAL EXPOSURE"

LUNGS, THORAX, OR RESPIRATION: CYANOSIS

CARDIAC: PULSE RATE
Arzneimittel-Forschung. Drug Research. Vol. 18, Pg. 989, 1968.
rat LD50 intraperitoneal 750ug/kg (0.75mg/kg)   Developments in Food Science. Vol. 4, Pg. 135, 1983.
rat LD50 intravenous 1300ug/kg (1.3mg/kg) SKIN AND APPENDAGES (SKIN): "DERMATITIS, ALLERGIC: AFTER TOPICAL EXPOSURE"

CARDIAC: PULSE RATE

LUNGS, THORAX, OR RESPIRATION: CYANOSIS
Arzneimittel-Forschung. Drug Research. Vol. 18, Pg. 989, 1968.
rat LD50 oral 7mg/kg (7mg/kg)   Veterinary and Human Toxicology. Vol. 25, Pg. 335, 1983.
women TDLo intraperitoneal 12mg/kg/5D (12mg/kg) GASTROINTESTINAL: NAUSEA OR VOMITING

BEHAVIORAL: MUSCLE WEAKNESS
Cancer Treatment Reports. Vol. 63, Pg. 789, 1979.