PHOLCODINE MONOHYDRATE

Details

Stereochemistry	ABSOLUTE
Molecular Formula	C23H30N2O4.H2O
Molecular Weight	416.5106
Optical Activity	UNSPECIFIED
Defined Stereocenters	5 / 5
E/Z Centers	0
Charge	0

SHOW SMILES / InChI

Structure Search

SMILES

O.[H][C@@]12OC3=C4C(C[C@@]5([H])N(C)CC[C@@]14[C@@]5([H])C=C[C@@H]2O)=CC=C3OCCN6CCOCC6

InChI

InChIKey=VOMHFFCEDKOLBR-RNFKYSJUSA-N

InChI=1S/C23H30N2O4.H2O/c1-24-7-6-23-16-3-4-18(26)22(23)29-21-19(5-2-15(20(21)23)14-17(16)24)28-13-10-25-8-11-27-12-9-25;/h2-5,16-18,22,26H,6-14H2,1H3;1H2/t16-,17+,18-,22-,23-;/m0./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	C23H30N2O4
Molecular Weight	398.4953
Charge	0
Count

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

Approval Year

Substance Class	Chemical Created by `admin` on `Sat Dec 16 10:03:31 UTC 2023` Edited by `admin` on `Sat Dec 16 10:03:31 UTC 2023`
Record UNII	538VG8KNRX
Record Status	`Validated (UNII)`
Record Version

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Name

Type

Language

PHOLCODINE MONOHYDRATE

Common Name

English

PHOLCODINE MONOHYDRATE [EP MONOGRAPH]

Common Name

English

MORPHINAN-6-OL, 7,8-DIDEHYDRO-4,5-EPOXY-17-METHYL-3-(2-(4-MORPHOLINYL)ETHOXY)-, MONOHYDRATE, (5.ALPHA.,6.ALPHA.)-

Systematic Name

English

PHOLCODINE [MART.]

Common Name

English

MORPHINAN-6-OL, 7,8-DIDEHYDRO-4,5-EPOXY-17-METHYL-3-(2-(4-MORPHOLINYL)ETHOXY)-, HYDRATE (1:1), (5.ALPHA.,6.ALPHA.)-

Systematic Name

English

MORPHINAN-6.ALPHA.-OL, 7,8-DIDEHYDRO-4,5.ALPHA.-EPOXY-17-METHYL-3-(2-MORPHOLINOETHOXY)-, HYDRATE

Systematic Name

English

PHOLCODINE MONOHYDRATE [MI]

Common Name

English

PHOLCODINE [EP IMPURITY]

Common Name

English

3-(2-MORPHOLINOETHYL)MORPHINE MONOHYDRATE

Systematic Name

English

Code System Code Type Description

MERCK INDEX

m8711