DOBUTAMINE PHOSPHATE

Details

Stereochemistry	RACEMIC
Molecular Formula	C18H23NO3.H3O4P
Molecular Weight	399.3753
Optical Activity	( + / - )
Defined Stereocenters	0 / 1
E/Z Centers	0
Charge	0

SHOW SMILES / InChI

Structure Search

SMILES

OP(O)(O)=O.CC(CCC1=CC=C(O)C=C1)NCCC2=CC(O)=C(O)C=C2

InChI

InChIKey=JJDDIKDNBCHINM-UHFFFAOYSA-N

InChI=1S/C18H23NO3.H3O4P/c1-13(2-3-14-4-7-16(20)8-5-14)19-11-10-15-6-9-17(21)18(22)12-15;1-5(2,3)4/h4-9,12-13,19-22H,2-3,10-11H2,1H3;(H3,1,2,3,4)

HIDE SMILES / InChI

Molecular Formula	C18H23NO3
Molecular Weight	301.3801
Charge	0
Count

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

Molecular Formula	H3O4P
Molecular Weight	97.9952
Charge	0
Count

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

Approval Year

Substance Class	Chemical Created by `admin` on `Sat Dec 16 11:13:46 UTC 2023` Edited by `admin` on `Sat Dec 16 11:13:46 UTC 2023`
Record UNII	8YJK630WIW
Record Status	`Validated (UNII)`
Record Version

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Name

Type

Language

DOBUTAMINE PHOSPHATE

Common Name

English

1,2-BENZENEDIOL, 4-(2-((3-(4-HYDROXYPHENYL)-1-METHYLPROPYL)AMINO)ETHYL)-, (±)-, PHOSPHATE (1:1) (SALT)

Common Name

English

1,2-BENZENEDIOL, 4-(2-((3-(4-HYDROXYPHENYL)-1-METHYLPROPYL)AMINO)ETHYL)-, PHOSPHATE (1:1) (SALT)

Systematic Name

English

Code System Code Type Description

CAS

120885-52-1

Created by admin on Sat Dec 16 11:13:46 UTC 2023 , Edited by admin on Sat Dec 16 11:13:46 UTC 2023

PRIMARY

FDA UNII

8YJK630WIW

Created by admin on Sat Dec 16 11:13:46 UTC 2023 , Edited by admin on Sat Dec 16 11:13:46 UTC 2023

PRIMARY

PUBCHEM

22366973

Created by admin on Sat Dec 16 11:13:46 UTC 2023 , Edited by admin on Sat Dec 16 11:13:46 UTC 2023

PRIMARY

CAS

120885-55-4

Created by admin on Sat Dec 16 11:13:46 UTC 2023 , Edited by admin on Sat Dec 16 11:13:46 UTC 2023

SUPERSEDED

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