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Substance Name: NT2 Purpurin
RN: 99128-91-3
InChIKey: DDIILYAGLAUTRS-UPBLMPEMSA-N

Note

  • Used in photodynamic therapy of induced tumors.

Molecular Formula

  • C41-H54-N4-O2

Molecular Weight

  • 632.8878
 
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Names and Synonyms

Name of Substance

  • NT2 Purpurin

Synonyms

  • NT-2 Purpurin
  • Purpurin NT 2

Systematic Name

  • 20-Phorbinecarboxylic acid, 3,4,20,21-tetradehydro-3,4,8,9,13,14,18,19-octaethyl-18,19-dihydro-, ethyl ester

Registry Numbers

CAS Registry Number

  • 99128-91-3

System Generated Number

  • 0099128913

Structure Descriptors

InChI

1S/C41H52N4O2/c1-10-23-24(11-2)34-21-36-27(14-5)28(15-6)38(44-36)29-19-31(40(46)47-18-9)41(17-8)30(16-7)37(45-39(29)41)22-35-26(13-4)25(12-3)33(43-35)20-32(23)42-34/h19-22,30,42,45H,10-18H2,1-9H3/b33-20-,36-21-,37-22-

InChIKey

DDIILYAGLAUTRS-UPBLMPEMSA-N

Smiles

CCc1c2/cc/3\nc(/cc/4\[nH]c5c(c6n/c(c\c(c1CC)[nH]2)/C(=C6CC)CC)C=C(C5(C4CC)CC)C(=O)OCC)C(=C3CC)CC