PASPALIC ACID

Details

Stereochemistry	ACHIRAL
Molecular Formula	C16H16N2O2
Molecular Weight	268.3104
Optical Activity	UNSPECIFIED
Defined Stereocenters	2 / 2
E/Z Centers	0
Charge	0

SHOW SMILES / InChI

Structure Search

SMILES

CN1CC(=C[C@H]2[C@H]1CC3=CNC4=C3C2=CC=C4)C(O)=O

InChI

InChIKey=RJNCJTROKRDRBW-TZMCWYRMSA-N

InChI=1S/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/h2-5,7,12,14,17H,6,8H2,1H3,(H,19,20)/t12-,14-/m1/s1

HIDE SMILES / InChI

Molecular Formula	C16H16N2O2
Molecular Weight	268.3104
Charge	0
Count

Stereochemistry	ABSOLUTE
Additional Stereochemistry	No
Defined Stereocenters	2 / 2
E/Z Centers	0
Optical Activity	UNSPECIFIED

Approval Year

Substance Class	Chemical Created by `admin` on `Mon Mar 31 18:08:59 GMT 2025` Edited by `admin` on `Mon Mar 31 18:08:59 GMT 2025`
Record UNII	P81DUK4Q2L
Record Status	`Validated (UNII)`
Record Version

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Name

Type

Language

PASPALIC ACID

Common Name

English

.DELTA.8-LYSERGIC ACID

Preferred Name

English

6-METHYLERGOL-8-ENE-8-CARBOXYLIC ACID

Common Name

English

ERGOLINE-8-CARBOXYLIC ACID, 8,9-DIDEHYDRO-6-METHYL-

Systematic Name

English

6-METHYL-ERGOL-8,9-ENE-8-CARBOXYLIC ACID

Common Name

English

Code System Code Type Description

EPA CompTox

DTXSID20203672

Created by admin on Mon Mar 31 18:08:59 GMT 2025 , Edited by admin on Mon Mar 31 18:08:59 GMT 2025

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CAS

5516-88-1

Created by admin on Mon Mar 31 18:08:59 GMT 2025 , Edited by admin on Mon Mar 31 18:08:59 GMT 2025

PRIMARY

PUBCHEM

21692

Created by admin on Mon Mar 31 18:08:59 GMT 2025 , Edited by admin on Mon Mar 31 18:08:59 GMT 2025

PRIMARY

FDA UNII

P81DUK4Q2L

Created by admin on Mon Mar 31 18:08:59 GMT 2025 , Edited by admin on Mon Mar 31 18:08:59 GMT 2025

PRIMARY