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Substance Name: N-(3-(4-Azido-3-iodophenyl)-propionamide)-7-aminoethylcarbamyl-7-desacetylforskolin
RN: 136133-69-2
InChIKey: SCYQBFSVKFFINI-LYCOBPPHSA-N

Molecular Formula

  • C32-H44-N5-O8

Molecular Weight

  • 753.6266
 
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Names and Synonyms

Name of Substance

  • N-(3-(4-Azido-3-iodophenyl)-propionamide)-7-aminoethylcarbamyl-7-desacetylforskolin

Synonyms

  • (3R-(3alpha,4abeta,5beta,6beta,6aalpha,10alpha,10abeta,10balpha))-3-Ethenyldodecahydro-6,10,10b-trihydroxy-3,4a,7,7,10a-pentamethyl-1-oxo-1H-naphtho(2,1-b)pyran-5-yl (2-((3-(4-azido-3-(iodo-125I)phenyl)-1-oxopropyl)amino)ethyl)carbamate
  • 7-Aipp-fsk-I125

Systematic Name

  • Carbamic acid, (2-((3-(4-azido-3-(iodo-125I)phenyl)-1-oxopropyl)amino)ethyl)-, 3-ethenyldodecahydro-6,10,10b-trihydroxy-3,4a,7,7,10a-pentamethyl-1-oxo-1H-naphtho(2,1-b)pyran-5-yl ester, (3R-(3alpha,4abeta,5beta,6beta,6aalpha,10alpha,10abeta,10balpha))-

Registry Numbers

CAS Registry Number

  • 136133-69-2

System Generated Number

  • 0136133692

Structure Descriptors

InChI

1S/C32H44IN5O8/c1-7-29(4)17-22(40)32(44)30(5)21(39)12-13-28(2,3)25(30)24(42)26(31(32,6)46-29)45-27(43)36-15-14-35-23(41)11-9-18-8-10-20(37-38-34)19(33)16-18/h7-8,10,16,21,24-26,39,42,44H,1,9,11-15,17H2,2-6H3,(H,35,41)(H,36,43)/t21-,24-,25-,26-,29-,30-,31+,32-/m0/s1

InChIKey

SCYQBFSVKFFINI-LYCOBPPHSA-N

Smiles

C[C@@]1(CC(=O)[C@@]2([C@]3([C@H](CCC([C@@H]3[C@@H]([C@@H]([C@]2(O1)C)OC(=O)NCCNC(=O)CCc4ccc(c(c4)I)N=[N+]=[N-])O)(C)C)O)C)O)C=C