18-Carboxy-8,13-diethyl-3,7,12,17-tetramethyl-21H,23H-porphine-2-propanoic acid

CAS Registry Number®

531-12-4

CAS Name

18-Carboxy-8,13-diethyl-3,7,12,17-tetramethyl-21H,23H-porphine-2-propanoic acid

Molecular Formula

C32H34N4O4

Molecular Mass

538.64

Cite this Page

18-Carboxy-8,13-diethyl-3,7,12,17-tetramethyl-21H,23H-porphine-2-propanoic acid.   CAS Common Chemistry.   CAS, a division of the American Chemical Society, n.d.   http://commonchemistry.cas.org/detail?cas_rn=531-12-4 (retrieved 2025-01-03) (CAS RN: 531-12-4).  Licensed under the Attribution-Noncommercial 4.0 International License (CC BY-NC 4.0).

Other Names and Identifiers

InChI

InChI=1S/C32H34N4O4/c1-7-19-15(3)22-11-23-17(5)21(9-10-30(37)38)28(35-23)14-29-31(32(39)40)18(6)25(36-29)13-27-20(8-2)16(4)24(34-27)12-26(19)33-22/h11-14,34-35H,7-10H2,1-6H3,(H,37,38)(H,39,40)/b22-11?,23-11-,24-12?,25-13-,26-12-,27-13?,28-14-,29-14?

InChIKey

InChIKey=WDMIUJAVXIZYMP-LLQCOYHYSA-N

SMILES

C(CC(O)=O)C1=C2C=C3C(C(O)=O)=C(C)C(=N3)C=C4C(CC)=C(C)C(N4)=CC5=NC(=CC(N2)=C1C)C(C)=C5CC

Canonical SMILES

O=C(O)C=1C2=NC(=CC=3NC(C=C4N=C(C=C5NC(=C2)C(=C5C)CCC(=O)O)C(=C4CC)C)=C(C3CC)C)C1C

Other Names for this Substance

  • 21H,23H-Porphine-2-propanoic acid, 18-carboxy-8,13-diethyl-3,7,12,17-tetramethyl-
  • 18-Carboxy-8,13-diethyl-3,7,12,17-tetramethyl-21H,23H-porphine-2-propanoic acid
  • Rhodoporphyrin XV
  • NSC 407317

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