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Details

Stereochemistry ACHIRAL
Molecular Formula C32H34N4O4
Molecular Weight 538.6368
Optical Activity NONE
Defined Stereocenters 0 / 0
E/Z Centers 0
Charge 0

SHOW SMILES / InChI
Structure of Deuteroporphyrin dimethyl ester

SMILES

COC(=O)CCC1=C2NC(C=C3N=C(C=C3C)C=C4NC(C=C4C)=CC5=NC(=C2)C(CCC(=O)OC)=C5C)=C1C

InChI

InChIKey=MTXRVEYQSPRYBW-RWJCOFQGSA-N
InChI=1S/C32H34N4O4/c1-17-11-22-14-27-19(3)23(7-9-31(37)39-5)29(35-27)16-30-24(8-10-32(38)40-6)20(4)28(36-30)15-26-18(2)12-21(34-26)13-25(17)33-22/h11-16,33,36H,7-10H2,1-6H3/b21-13-,22-14-,25-13-,26-15-,27-14-,28-15-,29-16-,30-16-

HIDE SMILES / InChI

Approval Year

Name Type Language
Deuteroporphyrin dimethyl ester
Common Name English
21H,23H-PORPHINE-2,18-DIPROPANOIC ACID, 3,7,12,17-TETRAMETHYL-, 2,18-DIMETHYL ESTER
Common Name English
methyl 3-[20-(3-methoxy-3-oxopropyl)-5,9,14,19-tetramethyl-21,22,23,24-tetraazapentacyclo[16.2.1.1{3,6}.1{8,11}.1{13,16}]tetracosa-1(21),2,4,6,8(23),9,11,13,15,17,19-undecaen-4-yl]propanoate
Systematic Name English
Deuteroporphyrin IX dimethyl ester
Common Name English
Pyroporphyrin dimethyl ester
Common Name English
NSC-17451
Code English
2,18-Dimethyl 3,7,12,17-tetramethyl-21H,23H-porphine-2,18-dipropanoate
Systematic Name English
Dimethyl 3,7,12,17-tetramethyl-21H,23H-porphine-2,18-dipropionate
Systematic Name English
Code System Code Type Description
CAS
10589-94-3
Created by admin on Sat Dec 16 12:38:54 GMT 2023 , Edited by admin on Sat Dec 16 12:38:54 GMT 2023
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NSC
17451
Created by admin on Sat Dec 16 12:38:54 GMT 2023 , Edited by admin on Sat Dec 16 12:38:54 GMT 2023
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ECHA (EC/EINECS)
234-195-0
Created by admin on Sat Dec 16 12:38:54 GMT 2023 , Edited by admin on Sat Dec 16 12:38:54 GMT 2023
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EPA CompTox
DTXSID90889381
Created by admin on Sat Dec 16 12:38:54 GMT 2023 , Edited by admin on Sat Dec 16 12:38:54 GMT 2023
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FDA UNII
B2AR39YW5P
Created by admin on Sat Dec 16 12:38:54 GMT 2023 , Edited by admin on Sat Dec 16 12:38:54 GMT 2023
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