ETORPHINE

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National Institutes of Health Divider Arrow

NCATS

Details

Stereochemistry	ABSOLUTE
Molecular Formula	C25H33NO4
Molecular Weight	411.5338
Optical Activity	UNSPECIFIED
Defined Stereocenters	7 / 7
E/Z Centers	0
Charge	0

SHOW SMILES / InChI

Structure of ETORPHINE

Structure Search

SMILES

[H][C@@]12OC3=C(O)C=CC4=C3[C@@]15CCN(C)[C@]([H])(C4)[C@@]56C[C@]([H])([C@](C)(O)CCC)[C@]2(OC)C=C6

InChI

InChIKey=CAHCBJPUTCKATP-FAWZKKEFSA-N

InChI=1S/C25H33NO4/c1-5-8-22(2,28)17-14-23-9-10-25(17,29-4)21-24(23)11-12-26(3)18(23)13-15-6-7-16(27)20(30-21)19(15)24/h6-7,9-10,17-18,21,27-28H,5,8,11-14H2,1-4H3/t17-,18-,21-,22-,23-,24+,25-/m1/s1

HIDE SMILES / InChI

Molecular Formula	C25H33NO4
Molecular Weight	411.5338
Charge	0
Count

Stereochemistry	ABSOLUTE
Additional Stereochemistry	No
Defined Stereocenters	7 / 7
E/Z Centers	0
Optical Activity	UNSPECIFIED

Approval Year

Substance Class	Chemical Created by `admin` on `Fri Dec 15 17:18:47 UTC 2023` Edited by `admin` on `Fri Dec 15 17:18:47 UTC 2023`
Record UNII	42M2Y6NU9O
Record Status	`Validated (UNII)`
Record Version

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Name

Type

Language

ETORPHINE

Official Name

English

etorphine [INN]

Common Name

English

6,7,8,14-TETRAHYDRO-7.ALPHA.-(1-HYDROXY-1-METHYLBUTYL)-6,14-ENDO-ETHENOORIPAVINE

Common Name

English

M-99 FREE BASE

Code

English

ETORPHINE [MI]

Common Name

English

7.ALPHA.-(1(R)-HYDROXY-1-METHYLBUTYL)-6,14-ENDO-ETHENOTETRAHYDROORIPAVINE

Common Name

English

19-PROPYLORVINOL

Common Name

English

IDS-NE-007

Code

English

IDS-NE-007(SECT.3)

Code

English

M. 99 FREE BASE

Code

English

TETRAHYDRO-7.ALPHA.-(2-HYDROXY-2-PENTYL)-6,14-ENDO-ETHENOORIPAVINE

Common Name

English

ETORPHINE [HSDB]

Common Name

English

7,8-DIHYDRO-7.ALPHA.-(1(R)-HYDROXY-1-METHYLBUTYL)-O SUP(6)-METHYL-6,14-ENDO-ETHENOMORPHINE

Common Name

English

PROPYLORVINOL

Common Name

English

TETRAHYDRO-7.ALPHA.-(1-HYDROXY-1-METHYLBUTYL)-6,14-ENDO-ETHENOORIPAVINE

Common Name

English

(5.ALPHA.,7.ALPHA.(R))-4,5-EPOXY-3-HYDROXY-6-METHOXY-.ALPHA.,17-DIMETHYL-.ALPHA.-PROPYL-6,14-ETHENOMORPHINAN-7-METHANOL

Common Name

English

Classification Tree Code System Code

WHO-VATC

QN02AE90

Created by admin on Fri Dec 15 17:18:47 UTC 2023 , Edited by admin on Fri Dec 15 17:18:47 UTC 2023

NCI_THESAURUS

C67413

Created by admin on Fri Dec 15 17:18:47 UTC 2023 , Edited by admin on Fri Dec 15 17:18:47 UTC 2023

DEA NO.

9056

Created by admin on Fri Dec 15 17:18:47 UTC 2023 , Edited by admin on Fri Dec 15 17:18:47 UTC 2023

Code System Code Type Description

MESH

D005048

Created by admin on Fri Dec 15 17:18:47 UTC 2023 , Edited by admin on Fri Dec 15 17:18:47 UTC 2023

PRIMARY

PUBCHEM

644209

Created by admin on Fri Dec 15 17:18:47 UTC 2023 , Edited by admin on Fri Dec 15 17:18:47 UTC 2023

PRIMARY

CAS

14521-96-1

Created by admin on Fri Dec 15 17:18:47 UTC 2023 , Edited by admin on Fri Dec 15 17:18:47 UTC 2023

PRIMARY

CHEBI

4912

Created by admin on Fri Dec 15 17:18:47 UTC 2023 , Edited by admin on Fri Dec 15 17:18:47 UTC 2023

PRIMARY

HSDB

7601

Created by admin on Fri Dec 15 17:18:47 UTC 2023 , Edited by admin on Fri Dec 15 17:18:47 UTC 2023

PRIMARY

EVMPD

SUB07339MIG

Created by admin on Fri Dec 15 17:18:47 UTC 2023 , Edited by admin on Fri Dec 15 17:18:47 UTC 2023

PRIMARY

SMS_ID

100000082092

Created by admin on Fri Dec 15 17:18:47 UTC 2023 , Edited by admin on Fri Dec 15 17:18:47 UTC 2023

PRIMARY

EPA CompTox

DTXSID40878669

Created by admin on Fri Dec 15 17:18:47 UTC 2023 , Edited by admin on Fri Dec 15 17:18:47 UTC 2023

PRIMARY

ECHA (EC/EINECS)

238-535-9

Created by admin on Fri Dec 15 17:18:47 UTC 2023 , Edited by admin on Fri Dec 15 17:18:47 UTC 2023

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MERCK INDEX

m5201

Created by admin on Fri Dec 15 17:18:47 UTC 2023 , Edited by admin on Fri Dec 15 17:18:47 UTC 2023

PRIMARY

Merck Index

FDA UNII

42M2Y6NU9O

Created by admin on Fri Dec 15 17:18:47 UTC 2023 , Edited by admin on Fri Dec 15 17:18:47 UTC 2023

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WIKIPEDIA

ETORPHINE

Created by admin on Fri Dec 15 17:18:47 UTC 2023 , Edited by admin on Fri Dec 15 17:18:47 UTC 2023

PRIMARY

NCI_THESAURUS

C80578

Created by admin on Fri Dec 15 17:18:47 UTC 2023 , Edited by admin on Fri Dec 15 17:18:47 UTC 2023

PRIMARY

ChEMBL

CHEMBL1908334

Created by admin on Fri Dec 15 17:18:47 UTC 2023 , Edited by admin on Fri Dec 15 17:18:47 UTC 2023

PRIMARY

DRUG BANK

DB01497

Created by admin on Fri Dec 15 17:18:47 UTC 2023 , Edited by admin on Fri Dec 15 17:18:47 UTC 2023

PRIMARY

INN

2288

Created by admin on Fri Dec 15 17:18:47 UTC 2023 , Edited by admin on Fri Dec 15 17:18:47 UTC 2023

PRIMARY

Related Record Type Details


					8CBE01N748

ETORPHINE HYDROCHLORIDE

SALT/SOLVATE -> PARENT

Comments:

APPROXIMATE PURE ANHYDROUS DRUG CONTENT (IN PERCENT)

Amount:


					QQX8S479YV

DIHYDROETORPHINE

DERIVATIVE -> PARENT

Comments:

7,8-dihydro-7α-[1-(R)-hydroxy-1-methylbutyl]-6,14-endoethanotetrahydrooripavine (derivative of etorphine) as per INCB

Related Record Type Details


					42M2Y6NU9O

ETORPHINE

ACTIVE MOIETY