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Substance Name: alpha-Ergocryptam
RN: 77477-95-3
UNII: SJB8E6591T
InChIKey: IFFQSISDSKIQNF-MPISVETQSA-N

Molecular Formula

  • C32-H41-N5-O4

Molecular Weight

  • 559.7069
 
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Names and Synonyms

Name of Substance

  • alpha-Ergocryptam

Synonyms

  • alpha-Ergocryptam
  • Ergocryptam
  • Ergoline-8-carboxamide, 9,10-didehydro-6-methyl-N-((1S)-2-methyl-1-(((3S,8aR)-tetrahydro-3-(2-methylpropyl)-1,4-dioxopyrrolo(1,2-a)pyrazin-2(3H)-yl)carbonyl)propyl)-, (8beta)- 1',12'-secoergotaman-3',6',12',18-tetrone, 2'-deoxy-2'-(1-methylethyl)-5
  • N-(D-Lysergyl-L-valyl)-cyclo(L-leucyl-D-prolyl)
  • N-(Lysergyl-valyl)-cyclo(leucyl-D-prolyl)
  • UNII-SJB8E6591T

Registry Numbers

CAS Registry Number

  • 77477-95-3

FDA UNII

  • SJB8E6591T

System Generated Number

  • 0077477953

Structure Descriptors

InChI

1S/C32H41N5O4/c1-17(2)12-26-30(39)36-11-7-10-24(36)31(40)37(26)32(41)28(18(3)4)34-29(38)20-13-22-21-8-6-9-23-27(21)19(15-33-23)14-25(22)35(5)16-20/h6,8-9,13,15,17-18,20,24-26,28,33H,7,10-12,14,16H2,1-5H3,(H,34,38)/t20-,24-,25-,26+,28+/m1/s1

InChIKey

IFFQSISDSKIQNF-MPISVETQSA-N

Smiles

CC(C)C[C@@H]1N(C(=O)[C@@H](NC(=O)[C@H]2CN(C)[C@@H]3Cc4c[nH]c5cccc(C3=C2)c45)C(C)C)C(=O)[C@H]6CCCN6C1=O