Morphine meconate pentahydrate

Details

Stereochemistry	ABSOLUTE
Molecular Formula	2C17H19NO3.C7H4O7.5H2O
Molecular Weight	860.8542
Optical Activity	UNSPECIFIED
Defined Stereocenters	10 / 10
E/Z Centers	0
Charge	0

SHOW SMILES / InChI

Structure of Morphine meconate pentahydrate

Structure Search

SMILES

O.O.O.O.O.OC(=O)C1=CC(=O)C(O)=C(O1)C(O)=O.CN2CC[C@@]34[C@H]5OC6=C3C(C[C@@H]2[C@@H]4C=C[C@@H]5O)=CC=C6O.CN7CC[C@@]89[C@H]%10OC%11=C8C(C[C@@H]7[C@@H]9C=C[C@@H]%10O)=CC=C%11O

InChI

InChIKey=GNUHCAVXIYRGID-RTSZDRIGSA-N

InChI=1S/2C17H19NO3.C7H4O7.5H2O/c2*1-18-7-6-17-10-3-5-13(20)16(17)21-15-12(19)4-2-9(14(15)17)8-11(10)18;8-2-1-3(6(10)11)14-5(4(2)9)7(12)13;;;;;/h2*2-5,10-11,13,16,19-20H,6-8H2,1H3;1,9H,(H,10,11)(H,12,13);5*1H2/t2*10-,11+,13-,16-,17-;;;;;;/m00....../s1

HIDE SMILES / InChI

Molecular Formula	H2O
Molecular Weight	18.0153
Charge	0
Count

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

Molecular Formula	C17H19NO3
Molecular Weight	285.3377
Charge	0
Count

Stereochemistry	ABSOLUTE
Additional Stereochemistry	No
Defined Stereocenters	5 / 5
E/Z Centers	0
Optical Activity	UNSPECIFIED

Molecular Formula	C7H4O7
Molecular Weight	200.1025
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 `Mon Mar 31 23:07:06 GMT 2025` Edited by `admin` on `Mon Mar 31 23:07:06 GMT 2025`
Record UNII	Q9YBR2YM9U
Record Status	`Validated (UNII)`
Record Version

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Name

Type

Language

4H-Pyran-2,6-dicarboxylic acid, 3-hydroxy-4-oxo-, compd. with morphine (1:2), pentahydrate

Preferred Name

English

Morphine meconate pentahydrate

Common Name

English

4H-Pyran-2,6-dicarboxylic acid, 3-hydroxy-4-oxo-, compd. with (5?,6?)-7,8-didehydro-4,5-epoxy-17-methylmorphinan-3,6-diol (1:2), pentahydrate

Systematic Name

English

Morphinan-3,6?-diol, 7,8-didehydro-4,5?-epoxy-17-methyl-, compd. with 3-hydroxy-4-oxo-4H-pyran-2,6-dicarboxylic acid (2:1), pentahydrate

Common Name

English

Morphinan-3,6-diol, 7,8-didehydro-4,5-epoxy-17-methyl- (5?,6?)-, 3-hydroxy-4-oxo-4H-pyran-2,6-dicarboxylate (2:1) (salt), pentahydrate

Common Name

English

Code System Code Type Description

CAS

6209-40-1

Created by admin on Mon Mar 31 23:07:06 GMT 2025 , Edited by admin on Mon Mar 31 23:07:06 GMT 2025

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FDA UNII

Q9YBR2YM9U

Created by admin on Mon Mar 31 23:07:06 GMT 2025 , Edited by admin on Mon Mar 31 23:07:06 GMT 2025

PRIMARY

Related Record Type Details


					76I7G6D29C

MORPHINE

PARENT -> SALT/SOLVATE

Amount: