ETRYPTAMINE ACETATE

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NCATS

Details

Stereochemistry	RACEMIC
Molecular Formula	C12H16N2.C2H4O2
Molecular Weight	248.3208
Optical Activity	( + / - )
Defined Stereocenters	0 / 1
E/Z Centers	0
Charge	0

SHOW SMILES / InChI

Structure of ETRYPTAMINE ACETATE

Structure Search

SMILES

CC(O)=O.CCC(N)CC1=CNC2=C1C=CC=C2

InChI

InChIKey=TUQLBJAHRWROHB-UHFFFAOYSA-N

InChI=1S/C12H16N2.C2H4O2/c1-2-10(13)7-9-8-14-12-6-4-3-5-11(9)12;1-2(3)4/h3-6,8,10,14H,2,7,13H2,1H3;1H3,(H,3,4)

HIDE SMILES / InChI

Molecular Formula	C2H4O2
Molecular Weight	60.052
Charge	0
Count

Stereochemistry	ACHIRAL
Additional Stereochemistry	No
Defined Stereocenters	0 / 0
E/Z Centers	0
Optical Activity	NONE

Molecular Formula	C12H16N2
Molecular Weight	188.2688
Charge	0
Count

Stereochemistry	RACEMIC
Additional Stereochemistry	No
Defined Stereocenters	0 / 1
E/Z Centers	0
Optical Activity	( + / - )

Approval Year

Substance Class	Chemical Created by `admin` on `Fri Dec 15 16:17:30 UTC 2023` Edited by `admin` on `Fri Dec 15 16:17:30 UTC 2023`
Record UNII	3RY07R55EE
Record Status	`Validated (UNII)`
Record Version

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Name

Type

Language

ETRYPTAMINE ACETATE

Official Name

English

1H-INDOLE-3-ETHANAMINE, .ALPHA.-ETHYL-, ACETATE (1:1)

Systematic Name

English

ETRYPTAMINE ACETATE [INCB:GREEN LIST]

Common Name

English

1H-INDOLE-3-ETHANAMINE, .ALPHA.-ETHYL-, MONOACETATE

Systematic Name

English

ETRYPTAMINE ACETATE [USAN]

Common Name

English

(±)-.ALPHA.-ETHYLTRYPTAMINE ACETATE

Systematic Name

English

U-17312E

Code

English

3-(2-Aminobutyl)indole monoacetate

Systematic Name

English

ETRYPTAMINE ACETATE [MI]

Common Name

English

NSC-63963

Code

English

Classification Tree Code System Code

NCI_THESAURUS

C667

Created by admin on Fri Dec 15 16:17:30 UTC 2023 , Edited by admin on Fri Dec 15 16:17:30 UTC 2023

Code System Code Type Description

DRUG BANK

DBSALT000188

Created by admin on Fri Dec 15 16:17:30 UTC 2023 , Edited by admin on Fri Dec 15 16:17:30 UTC 2023

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ChEMBL

CHEMBL1619758

Created by admin on Fri Dec 15 16:17:30 UTC 2023 , Edited by admin on Fri Dec 15 16:17:30 UTC 2023

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CAS

118-68-3

Created by admin on Fri Dec 15 16:17:30 UTC 2023 , Edited by admin on Fri Dec 15 16:17:30 UTC 2023

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MERCK INDEX

m727

Created by admin on Fri Dec 15 16:17:30 UTC 2023 , Edited by admin on Fri Dec 15 16:17:30 UTC 2023

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Merck Index

ECHA (EC/EINECS)

204-268-1

Created by admin on Fri Dec 15 16:17:30 UTC 2023 , Edited by admin on Fri Dec 15 16:17:30 UTC 2023

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INCB IDS CODE

PE 006

Created by admin on Fri Dec 15 16:17:30 UTC 2023 , Edited by admin on Fri Dec 15 16:17:30 UTC 2023

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EPA CompTox

DTXSID2048876

Created by admin on Fri Dec 15 16:17:30 UTC 2023 , Edited by admin on Fri Dec 15 16:17:30 UTC 2023

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CAS

1083-68-7

Created by admin on Fri Dec 15 16:17:30 UTC 2023 , Edited by admin on Fri Dec 15 16:17:30 UTC 2023

NON-SPECIFIC STOICHIOMETRY

PUBCHEM

8366

Created by admin on Fri Dec 15 16:17:30 UTC 2023 , Edited by admin on Fri Dec 15 16:17:30 UTC 2023

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NCI_THESAURUS

C74236

Created by admin on Fri Dec 15 16:17:30 UTC 2023 , Edited by admin on Fri Dec 15 16:17:30 UTC 2023

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FDA UNII

3RY07R55EE

Created by admin on Fri Dec 15 16:17:30 UTC 2023 , Edited by admin on Fri Dec 15 16:17:30 UTC 2023

PRIMARY

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