ISOPENNICLAVINE

Details

Stereochemistry	ABSOLUTE
Molecular Formula	C16H18N2O2
Molecular Weight	270.3263
Optical Activity	UNSPECIFIED
Defined Stereocenters	2 / 2
E/Z Centers	0
Charge	0

SHOW SMILES / InChI

Structure Search

SMILES

CN1C[C@@](O)(CO)C=C2[C@H]1CC3=CNC4=C3C2=CC=C4

InChI

InChIKey=KCHBNRCSCHMJFD-GDBMZVCRSA-N

InChI=1S/C16H18N2O2/c1-18-8-16(20,9-19)6-12-11-3-2-4-13-15(11)10(7-17-13)5-14(12)18/h2-4,6-7,14,17,19-20H,5,8-9H2,1H3/t14-,16-/m1/s1

HIDE SMILES / InChI

Approval Year

Name

Type

Language

ISOPENNICLAVINE

Common Name

English

J691.021A

Preferred Name

English

9,10-DIDEHYDRO-8.BETA.-HYDROXY-6-METHYLERGOLINE-8-METHANOL

Systematic Name

English

ERGOLINE-8.ALPHA.-METHANOL, 9,10-DIDEHYDRO-8-HYDROXY-6-METHYL-

Systematic Name

English

ISOPENNICLAVIN

Common Name

English

ERGOLINE-8-METHANOL, 9,10-DIDEHYDRO-8-HYDROXY-6-METHYL-, (8.BETA.)-

Systematic Name

English

Code System Code Type Description

PUBCHEM

12311156

Created by admin on Mon Mar 31 23:07:34 GMT 2025 , Edited by admin on Mon Mar 31 23:07:34 GMT 2025

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FDA UNII

957F5HGG0I

Created by admin on Mon Mar 31 23:07:34 GMT 2025 , Edited by admin on Mon Mar 31 23:07:34 GMT 2025

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CAS

478-92-2

Created by admin on Mon Mar 31 23:07:34 GMT 2025 , Edited by admin on Mon Mar 31 23:07:34 GMT 2025

PRIMARY

EPA CompTox

DTXSID60963945

Created by admin on Mon Mar 31 23:07:34 GMT 2025 , Edited by admin on Mon Mar 31 23:07:34 GMT 2025

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SUBSTANCE RECORD


					957F5HGG0I

ISOPENNICLAVINE