ANHALONINE

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NCATS

Details

Stereochemistry	ABSOLUTE
Molecular Formula	C12H15NO3
Molecular Weight	221.2524
Optical Activity	UNSPECIFIED
Defined Stereocenters	1 / 1
E/Z Centers	0
Charge	0

SHOW SMILES / InChI

Structure of ANHALONINE

Structure Search

SMILES

COC1=C2OCOC2=C3[C@H](C)NCCC3=C1

InChI

InChIKey=YEGBVDVRKMCCON-ZETCQYMHSA-N

InChI=1S/C12H15NO3/c1-7-10-8(3-4-13-7)5-9(14-2)11-12(10)16-6-15-11/h5,7,13H,3-4,6H2,1-2H3/t7-/m0/s1

HIDE SMILES / InChI

Molecular Formula	C12H15NO3
Molecular Weight	221.2524
Charge	0
Count

Stereochemistry	ABSOLUTE
Additional Stereochemistry	No
Defined Stereocenters	1 / 1
E/Z Centers	0
Optical Activity	UNSPECIFIED

Approval Year

Substance Class	Chemical Created by `admin` on `Sat Dec 16 07:53:39 GMT 2023` Edited by `admin` on `Sat Dec 16 07:53:39 GMT 2023`
Record UNII	E29105F32F
Record Status	`Validated (UNII)`
Record Version

Download

Name

Type

Language

ANHALONINE

Common Name

English

1,3-DIOXOLO(4,5-H)ISOQUINOLINE, 6,7,8,9-TETRAHYDRO-4-METHOXY-9-METHYL-, (9S)-

Systematic Name

English

ANHALONINE [MI]

Common Name

English

Code System Code Type Description

PUBCHEM

16637831

Created by admin on Sat Dec 16 07:53:39 GMT 2023 , Edited by admin on Sat Dec 16 07:53:39 GMT 2023

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CAS

519-04-0

Created by admin on Sat Dec 16 07:53:39 GMT 2023 , Edited by admin on Sat Dec 16 07:53:39 GMT 2023

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FDA UNII

E29105F32F

Created by admin on Sat Dec 16 07:53:39 GMT 2023 , Edited by admin on Sat Dec 16 07:53:39 GMT 2023

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ECHA (EC/EINECS)

208-260-9

Created by admin on Sat Dec 16 07:53:39 GMT 2023 , Edited by admin on Sat Dec 16 07:53:39 GMT 2023

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EPA CompTox

DTXSID50966223

Created by admin on Sat Dec 16 07:53:39 GMT 2023 , Edited by admin on Sat Dec 16 07:53:39 GMT 2023

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MERCK INDEX

m1918

Created by admin on Sat Dec 16 07:53:39 GMT 2023 , Edited by admin on Sat Dec 16 07:53:39 GMT 2023

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Merck Index