U.S. Department of Health & Human Services Divider Arrow National Institutes of Health Divider Arrow NCATS

Details

Stereochemistry ABSOLUTE
Molecular Formula C16H18N2O2
Molecular Weight 270.3263
Optical Activity UNSPECIFIED
Defined Stereocenters 3 / 3
E/Z Centers 0
Charge 0

SHOW SMILES / InChI
Structure of 9,10-DIHYDROLYSERGIC ACID

SMILES

[H][C@@]12CC3=CNC4=C3C(=CC=C4)[C@@]1([H])C[C@H](CN2C)C(O)=O

InChI

InChIKey=ORBSYPFBZQJNJE-MPKXVKKWSA-N
InChI=1S/C16H18N2O2/c1-18-8-10(16(19)20)5-12-11-3-2-4-13-15(11)9(7-17-13)6-14(12)18/h2-4,7,10,12,14,17H,5-6,8H2,1H3,(H,19,20)/t10-,12-,14-/m1/s1

HIDE SMILES / InChI

Molecular Formula C16H18N2O2
Molecular Weight 270.3263
Charge 0
Count
Stereochemistry ABSOLUTE
Additional Stereochemistry No
Defined Stereocenters 3 / 3
E/Z Centers 0
Optical Activity UNSPECIFIED

Approval Year

Patents

Patents

Substance Class Chemical
Created
by admin
on Fri Dec 15 15:55:29 GMT 2023
Edited
by admin
on Fri Dec 15 15:55:29 GMT 2023
Record UNII
CT5L8OXT9Q
Record Status Validated (UNII)
Record Version
  • Download
Name Type Language
9,10-DIHYDROLYSERGIC ACID
Common Name English
9,10.ALPHA.-DIHYDROLYSERGIC ACID
Common Name English
6-METHYL-8.BETA.-CARBOXYERGOLINE
Systematic Name English
9,10-DIHYDROLYSERGIC ACID, (-)-
Common Name English
CODERGOCRINE MESILATE IMPURITY H [EP IMPURITY]
Common Name English
ERGOLINE-8.BETA.-CARBOXYLIC ACID, 6-METHYL-
Common Name English
6-METHYL-8.BETA.-ERGOLINECARBOXYLIC ACID
Systematic Name English
ERGOLINE-8-CARBOXYLIC ACID, 6-METHYL-, (8.BETA.)-
Common Name English
9,10-DIHYDRO-D-LYSERGIC ACID
Common Name English
LYSERGIC ACID, DIHYDRO-
Common Name English
9,10-DIHYDROLYSERGIC ACID I
Common Name English
Code System Code Type Description
ECHA (EC/EINECS)
227-551-1
Created by admin on Fri Dec 15 15:55:29 GMT 2023 , Edited by admin on Fri Dec 15 15:55:29 GMT 2023
PRIMARY
EPA CompTox
DTXSID90974307
Created by admin on Fri Dec 15 15:55:29 GMT 2023 , Edited by admin on Fri Dec 15 15:55:29 GMT 2023
PRIMARY
CAS
5878-43-3
Created by admin on Fri Dec 15 15:55:29 GMT 2023 , Edited by admin on Fri Dec 15 15:55:29 GMT 2023
PRIMARY
FDA UNII
CT5L8OXT9Q
Created by admin on Fri Dec 15 15:55:29 GMT 2023 , Edited by admin on Fri Dec 15 15:55:29 GMT 2023
PRIMARY
MESH
C041092
Created by admin on Fri Dec 15 15:55:29 GMT 2023 , Edited by admin on Fri Dec 15 15:55:29 GMT 2023
PRIMARY
PUBCHEM
12940526
Created by admin on Fri Dec 15 15:55:29 GMT 2023 , Edited by admin on Fri Dec 15 15:55:29 GMT 2023
PRIMARY
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PARENT -> IMPURITY