21H,23H-Porphine-2,8,12,18-tetrapropanoic acid, 3,7,13,17-tetrakis(carboxymethyl)-
CAS Registry Number®
531-42-0
No image available.
CAS Name
21H,23H-Porphine-2,8,12,18-tetrapropanoic acid, 3,7,13,17-tetrakis(carboxymethyl)-Molecular Formula
C40H38N4O16Molecular Mass
830.75Cite this Page
21H,23H-Porphine-2,8,12,18-tetrapropanoic acid, 3,7,13,17-tetrakis(carboxymethyl)-. CAS Common Chemistry. CAS, a division of the American Chemical Society, n.d. http://commonchemistry.cas.org/detail?cas_rn=531-42-0 (retrieved ) (CAS RN: 531-42-0). Licensed under the Attribution-Noncommercial 4.0 International License (CC BY-NC 4.0).Other Names and Identifiers
InChI
InChI=1S/C40H38N4O16/c45-33(46)5-1-17-21(9-37(53)54)29-15-30-23(11-39(57)58)19(3-7-35(49)50)27(43-30)14-28-20(4-8-36(51)52)24(12-40(59)60)32(44-28)16-31-22(10-38(55)56)18(2-6-34(47)48)26(42-31)13-25(17)41-29/h13-16,41,44H,1-12H2,(H,45,46)(H,47,48)(H,49,50)(H,51,52)(H,53,54)(H,55,56)(H,57,58)(H,59,60)/b25-13-,26-13?,27-14-,28-14?,29-15-,30-15?,31-16-,32-16?
InChIKey
InChIKey=RIOXJPSZPPGEKJ-WZLYLMGVSA-N
SMILES
C(CC(O)=O)C1=C2NC(=C1CC(O)=O)C=C3C(CC(O)=O)=C(CCC(O)=O)C(=N3)C=C4NC(=CC5=NC(=C2)C(CCC(O)=O)=C5CC(O)=O)C(CC(O)=O)=C4CCC(O)=O
Canonical SMILES
O=C(O)CC=1C=2N=C(C=C3NC(=CC4=NC(=CC=5NC(C2)=C(C5CCC(=O)O)CC(=O)O)C(=C4CC(=O)O)CCC(=O)O)C(=C3CCC(=O)O)CC(=O)O)C1CCC(=O)O
Other Names for this Substance
- 21H,23H-Porphine-2,8,12,18-tetrapropanoic acid, 3,7,13,17-tetrakis(carboxymethyl)-
- Uroporphyrin II
- 2,8,12,18-Porphinetetrapropionic acid, 3,7,13,17-tetrakis(carboxymethyl)-
