DEHYDROISOEMETINE DIHYDROBROMIDE

Details

Stereochemistry	ABSOLUTE
Molecular Formula	C29H38N2O4.2BrH
Molecular Weight	640.447
Optical Activity	UNSPECIFIED
Defined Stereocenters	2 / 2
E/Z Centers	0
Charge	0

SHOW SMILES / InChI

Structure of DEHYDROISOEMETINE DIHYDROBROMIDE

Structure Search

SMILES

Br.Br.[H][C@@]12CC(C[C@@H]3NCCC4=CC(OC)=C(OC)C=C34)=C(CC)CN1CCC5=CC(OC)=C(OC)C=C25

InChI

InChIKey=IRZYJLQDCUNDMY-LXTBHBSOSA-N

InChI=1S/C29H38N2O4.2BrH/c1-6-18-17-31-10-8-20-14-27(33-3)29(35-5)16-23(20)25(31)12-21(18)11-24-22-15-28(34-4)26(32-2)13-19(22)7-9-30-24;;/h13-16,24-25,30H,6-12,17H2,1-5H3;2*1H/t24-,25-;;/m0../s1

HIDE SMILES / InChI

Molecular Formula	BrH
Molecular Weight	80.912
Charge	0
Count

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

Molecular Formula	C29H38N2O4
Molecular Weight	478.623
Charge	0
Count

Stereochemistry	ABSOLUTE
Additional Stereochemistry	No
Defined Stereocenters	2 / 2
E/Z Centers	0
Optical Activity	UNSPECIFIED

Approval Year

Substance Class	Chemical Created by `admin` on `Sat Dec 16 00:10:33 UTC 2023` Edited by `admin` on `Sat Dec 16 00:10:33 UTC 2023`
Record UNII	OI934276YZ
Record Status	`Validated (UNII)`
Record Version

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Name

Type

Language

DEHYDROISOEMETINE DIHYDROBROMIDE

Common Name

English

2-DEHYDRO-1'-ISOEMETINE DIHYDROBROMIDE

Common Name

English

EMETAN, 2,3-DIDEHYDRO-6',7',10,11-TETRAMETHOXY-, DIHYDROBROMIDE, (1'.BETA.)-

Common Name

English

2,3-DEHYDROISOEMETINE DIHYDROBROMIDE

Common Name

English

(-)-2,3-DEHYDROISOEMETINE DIHYDROBROMIDE [MI]

Common Name

English

1'-ISOEMETINE, 2,3-DIDEHYDRO-, DIHYDROBROMIDE

Common Name

English

ISOEMETINE, 2-DEHYDRO-, DIHYDROBROMIDE

Common Name

English

Code System Code Type Description

FDA UNII

OI934276YZ