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Substance Name: N-(3-(4-Azido-3-iodophenyl)propionamide)-6-aminoethylcarbamylforskolin
RN: 136103-68-9
InChIKey: QZSIAGIQDOMXEK-UZONJECRSA-N

Molecular Formula

  • C34-H46-I-N5-O9

Molecular Weight

  • 793.7634
 
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Names and Synonyms

Name of Substance

  • N-(3-(4-Azido-3-iodophenyl)propionamide)-6-aminoethylcarbamylforskolin

Synonyms

  • (125I)-6-Aipp-fsk
  • 2-(3-(4-Azido-3-iodophenyl)propanamido)-N-ethyl-6-(aminocarbonyl)forskolin
  • 6-Aipp-fsk
  • 6-Aipp-fsk-125I

Systematic Name

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

Registry Numbers

CAS Registry Number

  • 136103-68-9

System Generated Number

  • 0136103689

Structure Descriptors

InChI

1S/C34H46IN5O9/c1-8-31(5)18-24(43)34(46)32(6)23(42)13-14-30(3,4)27(32)26(28(47-19(2)41)33(34,7)49-31)48-29(45)38-16-15-37-25(44)12-10-20-9-11-22(39-40-36)21(35)17-20/h8-9,11,17,23,26-28,42,46H,1,10,12-16,18H2,2-7H3,(H,37,44)(H,38,45)/t23-,26-,27-,28-,31-,32-,33+,34-/m0/s1/i35-2

InChIKey

QZSIAGIQDOMXEK-UZONJECRSA-N

Smiles

CC(=O)O[C@H]1[C@H]([C@@H]2[C@]([C@H](CCC2(C)C)O)([C@@]3([C@@]1(O[C@@](CC3=O)(C)C=C)C)O)C)OC(=O)NCCNC(=O)CCc4ccc(c(c4)[125I])N=[N+]=[N-]