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Substance Name: Tryptoquivalone
RN: 55387-46-7
UNII: 3QAI9CTO3Q
InChIKey: KKKXNFWTLBZDAQ-RDUQTRIHSA-N

Note

  • Tremor-producing metabolite from Aspergillus clavatus; tetrapeptide derived from tryptophan, anthranilic acid, valine & alanine.

Molecular Formula

  • C26-H24-N4-O6

Molecular Weight

  • 488.4976
 
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Names and Synonyms

Name of Substance

  • Tryptoquivalone

Synonyms

  • Nortryptoquivalone
  • Tryptoquivaline B
  • Tryptoquivalone
  • UNII-3QAI9CTO3Q

Systematic Names

  • (2'S-(2'alpha,9'alpha(R*),9'abeta))-1',3,4,9'a-Tetrahydro-1'-hydroxy-2'-methyl-4-(2-(2-methyl-1-oxopropyl)-4-oxo-3(4H)-quinazolinyl)spiro(furan-2(5H),9'-(9H)imidazo(1,2-a)indole)-3',5(2'H)-dione
  • Spiro(furan-2(5H),9'-(9H)imidazo(1,2-a)indole)-3',5(2'H)-dione, 1',3,4,9'a-tetrahydro-1'-hydroxy-2'-methyl-4-(2-(2-methyl-1-oxopropytl)-4-oxo-3(4H)-quinazolinyl)-, (2S,2'S,4R,9'aS)-

Registry Numbers

CAS Registry Number

  • 55387-46-7

FDA UNII

  • 3QAI9CTO3Q

System Generated Number

  • 0055387467

Structure Descriptors

InChI

1S/C26H24N4O6/c1-13(2)20(31)21-27-17-10-6-4-8-15(17)23(33)28(21)19-12-26(36-24(19)34)16-9-5-7-11-18(16)29-22(32)14(3)30(35)25(26)29/h4-11,13-14,19,25,35H,12H2,1-3H3/t14-,19+,25-,26-/m0/s1

InChIKey

KKKXNFWTLBZDAQ-RDUQTRIHSA-N

Smiles

CC(C)C(=O)C1=Nc2ccccc2C(=O)N1[C@@H]3C[C@@]4(OC3=O)[C@@H]5N(O)[C@@H](C)C(=O)N5c6ccccc46