Chemical Compound

Ergotaman-3',6',18-trione, 12'-hydroxy-2'-methyl-5'-(phenylmethyl)-, (5'.alpha.)-, [R-(R*,R*)]-2,3-dihydroxybutanedioate (2:1) (salt)

CAS Registry Number 379-79-3
Ergotaman-3',6',18-trione, 12'-hydroxy-2'-methyl-5'-(phenylmethyl)-, (5'.alpha.)-, [R-(R*,R*)]-2,3-dihydroxybutanedioate (2:1) (salt) 结构式
Primary record

Ergotaman-3',6',18-trione, 12'-hydroxy-2'-methyl-5'-(phenylmethyl)-, (5'.alpha.)-, [R-(R*,R*)]-2,3-dihydroxybutanedioate (2:1) (salt)

库存
9,295 克
纯度
98.7 %
CAS
379-79-3

化合物标识与属性

CAS
379-79-3
PubChem CID
11722266
SMILES
C[C@@]1(C(=O)N2[C@H](C(=O)N3CCC[C@H]3[C@@]2(O1)O)CC4=CC=CC=C4)NC(=O)[C@H]5CN([C@@H]6CC7=CNC8=CC=CC(=C78)C6=C5)C.C[C@@]1(C(=O)N2[C@H](C(=O)N3CCC[C@H]3[C@@]2(O1)O)CC4=CC=CC=C4)NC(=O)[C@H]5CN([C@@H]6CC7=CNC8=CC=CC(=C78)C6=C5)C.[C@H]([C@@H](C(=O)O)O)(C(=O)O)O
Canonical SMILES
CN1C[C@H](C(=O)N[C@]2(C)O[C@@]3(O)[C@@H]4CCCN4C(=O)[C@H](Cc4ccccc4)N3C2=O)C=C2c3cccc4[nH]cc(c34)C[C@H]21.CN1C[C@H](C(=O)N[C@]2(C)O[C@@]3(O)[C@@H]4CCCN4C(=O)[C@H](Cc4ccccc4)N3C2=O)C=C2c3cccc4[nH]cc(c34)C[C@H]21.O=C(O)[C@@H](O)[C@H](O)C(=O)O

名称与同义词

  • ergotamine tartrate
  • Cornutamin
  • Ergotartrate
  • Migretamine
  • Ergostat
  • Femergin
  • Gynergen
  • Lingraine
  • Rigetamin
  • Wigrettes
  • Ergomar
  • Exmigra
  • Lingran
  • Secagyn
  • Secupan
  • Avetol
  • Ergate
  • Ergam
  • Neo-ergotin
  • Gotamine tartrate
  • Medihaler ergotamine
  • Ergotamine bitartrate
  • ERGOTAMINE
  • ETIN
  • Ergotamine hemitartrate
  • Ergotamine tartrate (VAN)
  • UNII-MRU5XH3B48
  • CCRIS 487
  • Ergotamine, tartrate (2:1)
  • Ergotamine tartrate [USP:JAN]
  • Ergotamine tartrate [USAN:JAN]
  • EINECS 206-835-9
  • Ergotamine tartrate (2:1) (salt)
  • NA2811
  • NSC 41869
  • UN2811
  • AKOS016008898
  • CID11722266
  • C33H35N5O5.1/2C4H6O6
  • C33-H35-N5-O5.1/2C4-H6-O6
  • 379-79-3
  • Ergotaman-3', 6',18-triona, 12'-hidroxi-2'-metil-5'-(fenilmetil)-, (5alfa)-, (2R, 3R)-2,3-dihidroxibutanodioato ( 2:1)
  • Ergotaman-3',6',18-trione, 12'-hydroxy-2'-methyl-5'-(phenylmethyl)-, (5'.alpha.)-, (2R,3R)-2,3-dihydroxybutanedioate (2:1) (salt)
  • Ergotaman-3',6',18-trione, 12'-hydroxy-2'-methyl-5'-(phenylmethyl)-, (5'.alpha.)-, [R-(R*,R*)]-2,3-dihydroxybutanedioate (2:1) (salt)
  • Ergotaman-3',6',18-trione, 12'-hydroxy-2'-methyl-5'-(phenylmethyl)-, (5'alpha)-, (R-(R*,R*))-2,3-dihydroxybutanedioate (2:1) (salt)