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Substance Name: Territrem B
RN: 70407-20-4
InChIKey: PBXNNDFKPQPJBB-VJLHXPKFSA-N

Note

  • Tremorgenic mycotoxin from Aspergillus terreus.

Classification Code

  • Drug / Therapeutic Agent

Molecular Formula

  • C29-H34-O9

Molecular Weight

  • 526.579
 
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Names and Synonyms

Name of Substance

  • Territrem B

Synonym

  • Territreme B

Systematic Names

  • 4H,11H-Naphtho(2,1-b)pyrano(3,4-e)pyran-1,11(5H)-dione, 4a,6,6a,12,12a,12b-hexahydro-4a,12a-dihydroxy-4,4,6a,12b-tetramethyl-9-(3,4,5-trimethoxyphenyl)-, (4aR,6aR,12aS,12bS)-
  • 4H,11H-Naphtho(2,1-b)pyrano(3,4-e)pyran-1,11(5H)-dione, 4a,6,6a,12,12a,12b-hexahydro-4a,12a-dihydroxy-4,4,6a,12b-tetramethyl-9-(3,4,5-trimethoxyphenyl)-, (4aR-(4a-alpha,6a-beta,12a-alpha,12b-beta))-

Registry Numbers

CAS Registry Number

  • 70407-20-4

System Generated Number

  • 0070407204

Structure Descriptors

InChI

1S/C29H34O9/c1-25(2)9-8-22(30)27(4)28(25,32)11-10-26(3)29(27,33)15-17-19(38-26)14-18(37-24(17)31)16-12-20(34-5)23(36-7)21(13-16)35-6/h8-9,12-14,32-33H,10-11,15H2,1-7H3/t26-,27+,28-,29-/m1/s1

InChIKey

PBXNNDFKPQPJBB-VJLHXPKFSA-N

Smiles

c1(OC)cc(cc(c1OC)OC)c1cc2O[C@@]3([C@@](Cc2c(o1)=O)([C@@]1([C@@](CC3)(C(C=CC1=O)(C)C)O)C)O)C

Toxicity

Organism Test Type Route Reported Dose (Normalized Dose) Effect Source
mouse LD50 intraperitoneal 9060ug/kg (9.06mg/kg)   Applied and Environmental Microbiology. Vol. 47, Pg. 98, 1984.