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Substance Name: Chlorin 5
RN: 518-16-1
InChIKey: XBSDPDLUDZEASO-WOUATSTBSA-N

Molecular Formula

  • C33-H34-N4-O5

Molecular Weight

  • 566.6546
 
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Names and Synonyms

Results Name

  • Chlorin 5

Synonym

  • Chlorin 5

Systematic Name

  • 21H,23H-Porphine-2-propanoic acid, 18-carboxy-20-(dihydroxymethyl)-8-ethenyl-13-ethyl-2,3-dihydro-3,7,12,17-tetramethyl-, delta-lactone

Registry Numbers

CAS Registry Number

  • 518-16-1

System Generated Number

  • 0000518161

Structure Descriptors

InChI

1S/C33H34N4O5/c1-7-18-14(3)21-11-23-16(5)20(9-10-27(38)39)30(36-23)29-31-28(32(40)42-33(29)41)17(6)24(37-31)13-26-19(8-2)15(4)22(35-26)12-25(18)34-21/h7,11-13,16,20,33-34,37,41H,1,8-10H2,2-6H3,(H,38,39)/b21-11-,22-12-,23-11-,24-13-,25-12-,26-13-,30-29+/t16-,20-,33?/m0/s1

InChIKey

XBSDPDLUDZEASO-WOUATSTBSA-N

Smiles

CCC1=C(/c/2c/c3c(c(c([nH]3)/cc/4\nc(c5c6c(c(/c(/[nH]6)c/c1n2)C)C(=O)OC5O)[C@H]([C@@H]4C)CCC(=O)O)C)C=C)C