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Details

Stereochemistry ABSOLUTE
Molecular Formula C26H24N4O6
Molecular Weight 488.492
Optical Activity UNSPECIFIED
Defined Stereocenters 4 / 4
E/Z Centers 0
Charge 0

SHOW SMILES / InChI
Structure of NORTRYPTOQUIVALONE

SMILES

[H][C@@]12N(O)[C@@H](C)C(=O)N1C3=C(C=CC=C3)[C@@]24C[C@@H](N5C(=O)C6=C(C=CC=C6)N=C5C(=O)C(C)C)C(=O)O4

InChI

InChIKey=KKKXNFWTLBZDAQ-RDUQTRIHSA-N
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

HIDE SMILES / InChI

Molecular Formula C26H24N4O6
Molecular Weight 488.492
Charge 0
Count
Stereochemistry ABSOLUTE
Additional Stereochemistry No
Defined Stereocenters 4 / 4
E/Z Centers 0
Optical Activity UNSPECIFIED

Approval Year

Substance Class Chemical
Created
by admin
on Thu Jul 06 17:27:38 UTC 2023
Edited
by admin
on Thu Jul 06 17:27:38 UTC 2023
Record UNII
3QAI9CTO3Q
Record Status Validated (UNII)
Record Version
  • Download
Name Type Language
NORTRYPTOQUIVALONE
Common Name English
TRYPTOQUIVALONE
Common Name English
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-OXOPROPYL)-4-OXO-3(4H)-QUINAZOLINYL)-, (2'S-(2'.ALPHA.,9'.BETA.(S*),9'A.ALPHA.))-
Systematic Name English
TRYPTOQUIVALINE B
Common Name English
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-OXOPROPYL)-4-OXO-3(4H)-QUINAZOLINYL)-, (2S,2'S,4R,9'AS)-
Systematic Name English
Code System Code Type Description
CAS
55387-46-7
Created by admin on Thu Jul 06 17:27:38 UTC 2023 , Edited by admin on Thu Jul 06 17:27:38 UTC 2023
PRIMARY
EPA CompTox
DTXSID50970729
Created by admin on Thu Jul 06 17:27:38 UTC 2023 , Edited by admin on Thu Jul 06 17:27:38 UTC 2023
PRIMARY
PUBCHEM
101042999
Created by admin on Thu Jul 06 17:27:38 UTC 2023 , Edited by admin on Thu Jul 06 17:27:38 UTC 2023
PRIMARY
FDA UNII
3QAI9CTO3Q
Created by admin on Thu Jul 06 17:27:38 UTC 2023 , Edited by admin on Thu Jul 06 17:27:38 UTC 2023
PRIMARY
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