Dihydroergocristam

Details

Stereochemistry	ABSOLUTE
Molecular Formula	C36H43N5O4
Molecular Weight	609.7577
Optical Activity	UNSPECIFIED
Defined Stereocenters	6 / 6
E/Z Centers	0
Charge	0

SHOW SMILES / InChI

Structure Search

SMILES

[H][C@@]12CCCN1C(=O)[C@H](CC3=CC=CC=C3)N(C(=O)[C@@H](NC(=O)[C@H]4CN(C)[C@]5([H])CC6=CNC7=CC=CC(=C67)[C@@]5(C)C4)C(C)C)C2=O

InChI

InChIKey=SYMOJTCOHVIELO-YACIHJIPSA-N

InChI=1S/C36H43N5O4/c1-21(2)31(35(45)41-28(16-22-10-6-5-7-11-22)33(43)40-15-9-14-27(40)34(41)44)38-32(42)24-18-36(3)25-12-8-13-26-30(25)23(19-37-26)17-29(36)39(4)20-24/h5-8,10-13,19,21,24,27-29,31,37H,9,14-18,20H2,1-4H3,(H,38,42)/t24-,27+,28+,29-,31+,36-/m1/s1

HIDE SMILES / InChI

Approval Year

Name

Type

Language

Dihydroergocristam

Common Name

English

N-[(2S)-1-[(3S,8aS)-3-benzyl-1,4-dioxohexahydropyrrolo[1,2-a]pyrazin-2(1H)-yl]-3-methyl-1-oxobutan-2-yl]-6-methylergoline-8β-carboxamide

Systematic Name

English

CODERGOCRINE MESILATE IMPURITY E [EP IMPURITY]

Common Name

English

Code System Code Type Description

FDA UNII

QQ4XC38W22

Created by admin on Sat Dec 16 19:54:21 GMT 2023 , Edited by admin on Sat Dec 16 19:54:21 GMT 2023

PRIMARY

PUBCHEM

168429549

Created by admin on Sat Dec 16 19:54:21 GMT 2023 , Edited by admin on Sat Dec 16 19:54:21 GMT 2023

PRIMARY

SUBSTANCE RECORD


					QQ4XC38W22

Dihydroergocristam