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Substance Name: Uroporphyrin I octamethyl ester
RN: 10170-03-3
UNII: 11PSF25S1Y
InChIKey: RZIFHRRCTMJBHH-GOJGWFAPSA-N

Molecular Formula

  • C48-H54-N4-O16

Molecular Weight

  • 942.967
 
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Names and Synonyms

Results Name

  • Uroporphyrin I octamethyl ester

Name of Substance

  • Uroporphyrin I octamethyl ester

Synonyms

  • EINECS 233-444-0
  • NSC 89197
  • UNII-11PSF25S1Y
  • Uroporphyrin I octamethyl ester

Systematic Names

  • 21H,23H-Porphine-2,7,12,17-tetraacetic acid, 3,8,13,18-tetrakis(3-methoxy-3-oxopropyl)-, 2,7,12,17-tetramethyl ester
  • 21H,23H-Porphine-2,7,12,17-tetrapropanoic acid, 3,8,13,18-tetrakis(2-methoxy-2-oxoethyl)-, tetramethyl ester
  • Tetramethyl 3,8,13,18-tetrakis(2-methoxy-2-oxoethyl)-21H,23H-porphine-2,7,12,17-tetrapropionate

Registry Numbers

CAS Registry Number

  • 10170-03-3

FDA UNII

  • 11PSF25S1Y

System Generated Number

  • 0010170033

Structure Descriptors

InChI

1S/C48H54N4O16/c1-61-41(53)13-9-25-29(17-45(57)65-5)37-22-34-27(11-15-43(55)63-3)31(19-47(59)67-7)39(51-34)24-36-28(12-16-44(56)64-4)32(20-48(60)68-8)40(52-36)23-35-26(10-14-42(54)62-2)30(18-46(58)66-6)38(50-35)21-33(25)49-37/h21-24,49,52H,9-20H2,1-8H3/b33-21-,34-22-,35-23-,36-24-,37-22-,38-21-,39-24-,40-23-

InChIKey

RZIFHRRCTMJBHH-GOJGWFAPSA-N

Smiles

c12C(CCC(=O)OC)=C(CC(=O)OC)c(n2)cc2[nH]c(c(c2CCC(=O)OC)CC(=O)OC)cc2C(=C(c(n2)cc2c(c(c([nH]2)c1)CC(OC)=O)CCC(OC)=O)CC(=O)OC)CCC(=O)OC