Registration Dossier

General information

Inventory

EC number:
201-431-9
EC name:
Lysergic acid
CAS number:
82-58-6

No inventory information available

Reference substance information

IUPAC name:
(4R,7R)-6-methyl-6,11-diazatetracyclo[7.6.1.0²,⁷.0¹²,¹⁶]hexadeca-1(16),2,9,12,14-pentaene-4-carboxylic acid
Synonyms
Names:
Identifier:
IUPAC name
Lysergic acid
(8β)-6-methyl-9,10-didehydroergoline-8-carboxylic acid

CAS information

CAS number:
82-58-6

Molecular and structural information

Molecular formula:
C16H16N2O2
Molecular weight:
ca. 268.31
SMILES notation:
c12c3C=4[C@H]([N@@](C[C@@H](C4)C(O)=O)C)Cc1c[nH]c2ccc3
InChl:
1/C16H16N2O2/c1-18-8-10(16(19)20)5-12-11-3-2-4-13-15(11)9(7-17-13)6-14(12)18/h2-5,7,10,14,17H,6,8H2,1H3,(H,19,20)/t10-,14-/m1/s1
Structural formula:
Chemical structure