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Substance Name: 2,4-Bis(1-decyloxyethyl)deuteroporphyrinyl-6,7-bisaspartic acid
RN: 129901-59-3
InChIKey: YMFIUAOWPPYHEW-CILYLQDRSA-N

Molecular Formula

  • C62-H88-N6-O12

Molecular Weight

  • 1109.4072
 
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Names and Synonyms

Name of Substance

  • 2,4-Bis(1-decyloxyethyl)deuteroporphyrinyl-6,7-bisaspartic acid

Synonyms

  • C10-DP
  • N,N'-((7,12-Bis(1-(decyloxy)ethyl)-3,8,13,17-tetramethyl-21H,23H-porphine-2,18-diyl)bis(1-oxo-3,1-propanediyl))bis-L-aspartic acid

Systematic Name

  • L-Aspartic acid, N,N'-((7,12-bis(1-(decyloxy)ethyl)-3,8,13,17-tetramethyl-21H,23H-porphine-2,18-diyl)bis(1-oxo-3,1-propanediyl))bis-

Registry Numbers

CAS Registry Number

  • 129901-59-3

System Generated Number

  • 0129901593

Structure Descriptors

InChI

1S/C62H88N6O12/c1-9-11-13-15-17-19-21-23-29-79-41(7)59-39(5)47-31-45-37(3)43(25-27-55(69)67-53(61(75)76)35-57(71)72)49(63-45)34-50-44(26-28-56(70)68-54(62(77)78)36-58(73)74)38(4)46(64-50)32-51-60(40(6)48(66-51)33-52(59)65-47)42(8)80-30-24-22-20-18-16-14-12-10-2/h31-34,41-42,53-54,64-65H,9-30,35-36H2,1-8H3,(H,67,69)(H,68,70)(H,71,72)(H,73,74)(H,75,76)(H,77,78)/b45-31-,46-32-,47-31-,48-33-,49-34-,50-34-,51-32-,52-33-/t41?,42?,53-,54-/m0/s1

InChIKey

YMFIUAOWPPYHEW-CILYLQDRSA-N

Smiles

CCCCCCCCCCOC(C)c1c(c2/cc/3\nc(/cc\4/c(c(/c(/[nH]4)c/c5n/c(c\c1[nH]2)/C(=C5C(C)OCCCCCCCCCC)C)C)CCC(=O)N[C@@H](CC(=O)O)C(=O)O)C(=C3C)CCC(=O)N[C@@H](CC(=O)O)C(=O)O)C