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Substance Name: Desocriptine [INN]
RN: 66759-48-6
UNII: 62P526DC98
InChIKey: OPAVODIYXVLOOM-MXBMDEFOSA-N

Molecular Formula

  • C32-H45-N5-O4

Molecular Weight

  • 563.7385
 
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Names and Synonyms

Name of Substance

  • Desocriptine [INN]

Synonyms

  • Desocriptine
  • Desocriptinum
  • UNII-62P526DC98

Systematic Name

  • 6'-Deoxo-9,10alpha-dihydro-beta-ergocryptine

Registry Numbers

CAS Registry Number

  • 66759-48-6

FDA UNII

  • 62P526DC98

System Generated Number

  • 0066759486

Structure Descriptors

InChI

1S/C32H45N5O4/c1-6-19(4)26-17-36-12-8-11-27(36)32(40)37(26)30(39)31(41-32,18(2)3)34-29(38)21-13-23-22-9-7-10-24-28(22)20(15-33-24)14-25(23)35(5)16-21/h7,9-10,15,18-19,21,23,25-27,33,40H,6,8,11-14,16-17H2,1-5H3,(H,34,38)/t19-,21+,23+,25+,26+,27-,31+,32-/m0/s1

InChIKey

OPAVODIYXVLOOM-MXBMDEFOSA-N

Smiles

CC[C@H](C)[C@H]1CN2CCC[C@H]2[C@]3(O)O[C@](NC(=O)[C@@H]4C[C@H]5[C@@H](Cc6c[nH]c7cccc5c67)N(C)C4)(C(C)C)C(=O)N13