METHYLERGONOVINE

U.S. Department of Health & Human Services Divider Arrow

National Institutes of Health Divider Arrow

NCATS

Details

Stereochemistry	ABSOLUTE
Molecular Formula	C20H25N3O2
Molecular Weight	339.4314
Optical Activity	UNSPECIFIED
Defined Stereocenters	3 / 3
E/Z Centers	0
Charge	0

SHOW SMILES / InChI

Structure of METHYLERGONOVINE

Structure Search

SMILES

[H][C@@]12CC3=CNC4=C3C(=CC=C4)C1=C[C@H](CN2C)C(=O)N[C@@H](CC)CO

InChI

InChIKey=UNBRKDKAWYKMIV-QWQRMKEZSA-N

InChI=1S/C20H25N3O2/c1-3-14(11-24)22-20(25)13-7-16-15-5-4-6-17-19(15)12(9-21-17)8-18(16)23(2)10-13/h4-7,9,13-14,18,21,24H,3,8,10-11H2,1-2H3,(H,22,25)/t13-,14+,18-/m1/s1

HIDE SMILES / InChI

Molecular Formula	C20H25N3O2
Molecular Weight	339.4314
Charge	0
Count

Stereochemistry	ABSOLUTE
Additional Stereochemistry	No
Defined Stereocenters	3 / 3
E/Z Centers	0
Optical Activity	UNSPECIFIED

Approval Year

Substance Class	Chemical Created by `admin` on `Sat Dec 16 17:45:11 UTC 2023` Edited by `admin` on `Sat Dec 16 17:45:11 UTC 2023`
Record UNII	W53L6FE61V
Record Status	`Validated (UNII)`
Record Version

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Name

Type

Language

METHYLERGONOVINE

Common Name

English

METHYLERGOMETRINE [HSDB]

Common Name

English

(8.BETA.)-N-((1S)-1-(HYDROXYMETHYL)PROPYL)-6-METHYL-9,10-DIDEHYDROERGOLINE-8-CARBOXAMIDE

Systematic Name

English

ERGOTYL

Brand Name

English

(8β)-N-[(2S)-1-hydroxybutan-2-yl]-6-methyl-9,10-didehydroergoline-8-carboxamide

Systematic Name

English

methylergometrine [INN]

Common Name

English

ERGOMETRINE MALEATE IMPURITY D [EP IMPURITY]

Common Name

English

METHYLERGONOVINE [VANDF]

Common Name

English

Methylergometrine [WHO-DD]

Common Name

English

METHYLERGONOVINE [MI]

Common Name

English

METHYLERGOMETRINE

Official Name

English

Classification Tree Code System Code

NCI_THESAURUS

C47795

Created by admin on Sat Dec 16 17:45:12 UTC 2023 , Edited by admin on Sat Dec 16 17:45:12 UTC 2023

NDF-RT

N0000007618

Created by admin on Sat Dec 16 17:45:12 UTC 2023 , Edited by admin on Sat Dec 16 17:45:12 UTC 2023

NDF-RT

N0000175827

Created by admin on Sat Dec 16 17:45:12 UTC 2023 , Edited by admin on Sat Dec 16 17:45:12 UTC 2023

WHO-VATC

QG02AB01

Created by admin on Sat Dec 16 17:45:12 UTC 2023 , Edited by admin on Sat Dec 16 17:45:12 UTC 2023

WHO-ATC

G02AC01

Created by admin on Sat Dec 16 17:45:12 UTC 2023 , Edited by admin on Sat Dec 16 17:45:12 UTC 2023

WHO-VATC

QG02AC01

Created by admin on Sat Dec 16 17:45:12 UTC 2023 , Edited by admin on Sat Dec 16 17:45:12 UTC 2023

WHO-ATC

G02AB01

Created by admin on Sat Dec 16 17:45:12 UTC 2023 , Edited by admin on Sat Dec 16 17:45:12 UTC 2023

NDF-RT

N0000007618

Created by admin on Sat Dec 16 17:45:12 UTC 2023 , Edited by admin on Sat Dec 16 17:45:12 UTC 2023

Code System Code Type Description

EPA CompTox

DTXSID00904978

Created by admin on Sat Dec 16 17:45:12 UTC 2023 , Edited by admin on Sat Dec 16 17:45:12 UTC 2023

PRIMARY

MERCK INDEX

m7412

Created by admin on Sat Dec 16 17:45:12 UTC 2023 , Edited by admin on Sat Dec 16 17:45:12 UTC 2023

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Merck Index

NCI_THESAURUS

C74105

Created by admin on Sat Dec 16 17:45:12 UTC 2023 , Edited by admin on Sat Dec 16 17:45:12 UTC 2023

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DAILYMED

W53L6FE61V

Created by admin on Sat Dec 16 17:45:12 UTC 2023 , Edited by admin on Sat Dec 16 17:45:12 UTC 2023

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EVMPD

SUB08868MIG

Created by admin on Sat Dec 16 17:45:12 UTC 2023 , Edited by admin on Sat Dec 16 17:45:12 UTC 2023

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INN

2900

Created by admin on Sat Dec 16 17:45:12 UTC 2023 , Edited by admin on Sat Dec 16 17:45:12 UTC 2023

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RXCUI

6883

Created by admin on Sat Dec 16 17:45:12 UTC 2023 , Edited by admin on Sat Dec 16 17:45:12 UTC 2023

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RxNorm

PUBCHEM

8226

Created by admin on Sat Dec 16 17:45:12 UTC 2023 , Edited by admin on Sat Dec 16 17:45:12 UTC 2023

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SMS_ID

100000080906

Created by admin on Sat Dec 16 17:45:12 UTC 2023 , Edited by admin on Sat Dec 16 17:45:12 UTC 2023

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DRUG CENTRAL

1764

Created by admin on Sat Dec 16 17:45:12 UTC 2023 , Edited by admin on Sat Dec 16 17:45:12 UTC 2023

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DRUG BANK

DB00353

Created by admin on Sat Dec 16 17:45:12 UTC 2023 , Edited by admin on Sat Dec 16 17:45:12 UTC 2023

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CAS

113-42-8

Created by admin on Sat Dec 16 17:45:12 UTC 2023 , Edited by admin on Sat Dec 16 17:45:12 UTC 2023

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HSDB

3364

Created by admin on Sat Dec 16 17:45:12 UTC 2023 , Edited by admin on Sat Dec 16 17:45:12 UTC 2023

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LACTMED

Methylergonovine

Created by admin on Sat Dec 16 17:45:12 UTC 2023 , Edited by admin on Sat Dec 16 17:45:12 UTC 2023

PRIMARY

ChEMBL

CHEMBL1201356

Created by admin on Sat Dec 16 17:45:12 UTC 2023 , Edited by admin on Sat Dec 16 17:45:12 UTC 2023

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IUPHAR

150

Created by admin on Sat Dec 16 17:45:12 UTC 2023 , Edited by admin on Sat Dec 16 17:45:12 UTC 2023

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FDA UNII

W53L6FE61V

Created by admin on Sat Dec 16 17:45:12 UTC 2023 , Edited by admin on Sat Dec 16 17:45:12 UTC 2023

PRIMARY

MESH

D008755

Created by admin on Sat Dec 16 17:45:12 UTC 2023 , Edited by admin on Sat Dec 16 17:45:12 UTC 2023

PRIMARY

ECHA (EC/EINECS)

204-027-0

Created by admin on Sat Dec 16 17:45:12 UTC 2023 , Edited by admin on Sat Dec 16 17:45:12 UTC 2023

PRIMARY

WIKIPEDIA

METHYLERGOMETRINE

Created by admin on Sat Dec 16 17:45:12 UTC 2023 , Edited by admin on Sat Dec 16 17:45:12 UTC 2023

PRIMARY

Related Record Type Details


					5EDH242U9O

METHYLERGONOVINE TARTRATE

SALT/SOLVATE -> PARENT

Amount:


					IR84JPZ1RK

METHYLERGONOVINE MALEATE

SALT/SOLVATE -> PARENT

Amount:

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					PR834Q503T

PARENT -> METABOLITE ACTIVE

Amount:

Related Record Type Details


					YMH3D0ZJWV

ERGONOVINE MALEATE

PARENT -> IMPURITY

Amount:

Related Record Type Details


					W53L6FE61V

METHYLERGONOVINE

ACTIVE MOIETY

Amount: