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Details

Stereochemistry ABSOLUTE
Molecular Formula C22H26N2O4
Molecular Weight 382.4528
Optical Activity UNSPECIFIED
Defined Stereocenters 4 / 4
E/Z Centers 1
Charge 0

SHOW SMILES / InChI
Structure of ISOCORYNOXEINE

SMILES

[H][C@@]12C[C@@H]([C@H](CN1CC[C@@]23C(=O)NC4=CC=CC=C34)C=C)C(=C/OC)\C(=O)OC

InChI

InChIKey=MUVGVMUWMAGNSY-VKCGGMIFSA-N
InChI=1S/C22H26N2O4/c1-4-14-12-24-10-9-22(17-7-5-6-8-18(17)23-21(22)26)19(24)11-15(14)16(13-27-2)20(25)28-3/h4-8,13-15,19H,1,9-12H2,2-3H3,(H,23,26)/b16-13+/t14-,15-,19-,22-/m0/s1

HIDE SMILES / InChI

Molecular Formula C22H26N2O4
Molecular Weight 382.4528
Charge 0
Count
Stereochemistry ABSOLUTE
Additional Stereochemistry No
Defined Stereocenters 4 / 4
E/Z Centers 1
Optical Activity UNSPECIFIED

Approval Year

Substance Class Chemical
Created
by admin
on Sat Dec 16 09:45:11 UTC 2023
Edited
by admin
on Sat Dec 16 09:45:11 UTC 2023
Record UNII
J18B596D11
Record Status Validated (UNII)
Record Version
  • Download
Name Type Language
ISOCORYNOXEINE
Common Name English
SPIRO(3H-INDOLE-3,1'(5'H)-INDOLIZINE)-7'-ACETIC ACID, 6'-ETHENYL-1,2,2',3',6',7',8',8'A-OCTAHYDRO-.ALPHA.-(METHOXYMETHYLENE)-2-OXO-, METHYL ESTER, (.ALPHA.E,1'S,6'R,7'S,8'AS)-
Systematic Name English
7-ISOCORYNOXEINE
Common Name English
CORYNOXAN-16-CARBOXYLIC ACID, 16,17,18,19-TETRADEHYDRO-17-METHOXY-2-OXO-, METHYL ESTER, (16E,20.ALPHA.)-
Common Name English
Code System Code Type Description
PUBCHEM
3037448
Created by admin on Sat Dec 16 09:45:11 UTC 2023 , Edited by admin on Sat Dec 16 09:45:11 UTC 2023
PRIMARY
EPA CompTox
DTXSID701317164
Created by admin on Sat Dec 16 09:45:11 UTC 2023 , Edited by admin on Sat Dec 16 09:45:11 UTC 2023
PRIMARY
DAILYMED
J18B596D11
Created by admin on Sat Dec 16 09:45:11 UTC 2023 , Edited by admin on Sat Dec 16 09:45:11 UTC 2023
PRIMARY
CAS
51014-29-0
Created by admin on Sat Dec 16 09:45:11 UTC 2023 , Edited by admin on Sat Dec 16 09:45:11 UTC 2023
PRIMARY
RXCUI
2562547
Created by admin on Sat Dec 16 09:45:11 UTC 2023 , Edited by admin on Sat Dec 16 09:45:11 UTC 2023
PRIMARY
FDA UNII
J18B596D11
Created by admin on Sat Dec 16 09:45:11 UTC 2023 , Edited by admin on Sat Dec 16 09:45:11 UTC 2023
PRIMARY
Related Record Type Details
PARENT -> CONSTITUENT ALWAYS PRESENT