Norbuprenorphine hydrochloride

Details

Stereochemistry	ABSOLUTE
Molecular Formula	C25H35NO4.ClH
Molecular Weight	450.011
Optical Activity	UNSPECIFIED
Defined Stereocenters	7 / 7
E/Z Centers	0
Charge	0

SHOW SMILES / InChI

Structure of Norbuprenorphine hydrochloride

Structure Search

SMILES

Cl.[H][C@@]12OC3=C4C(C[C@H]5NCC[C@@]14[C@@]56CC[C@@]2(OC)[C@]([H])(C6)[C@](C)(O)C(C)(C)C)=CC=C3O

InChI

InChIKey=HAFFMAAVKOFVLD-GAZCGFTGSA-N

InChI=1S/C25H35NO4.ClH/c1-21(2,3)22(4,28)16-13-23-8-9-25(16,29-5)20-24(23)10-11-26-17(23)12-14-6-7-15(27)19(30-20)18(14)24;/h6-7,16-17,20,26-28H,8-13H2,1-5H3;1H/t16-,17-,20-,22+,23-,24+,25-;/m1./s1

HIDE SMILES / InChI

Molecular Formula	ClH
Molecular Weight	36.461
Charge	0
Count

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

Molecular Formula	C25H35NO4
Molecular Weight	413.5497
Charge	0
Count

Stereochemistry	ABSOLUTE
Additional Stereochemistry	No
Defined Stereocenters	7 / 7
E/Z Centers	0
Optical Activity	UNSPECIFIED

Approval Year

Substance Class	Chemical Created by `admin` on `Sat Dec 16 18:30:14 UTC 2023` Edited by `admin` on `Sat Dec 16 18:30:14 UTC 2023`
Record UNII	ZJ6Q3WB4RJ
Record Status	`Validated (UNII)`
Record Version

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Name

Type

Language

Norbuprenorphine hydrochloride

Common Name

English

6,14-Ethenomorphinan-7-methanol, α-(1,1-dimethylethyl)-4,5-epoxy-18,19-dihydro-3-hydroxy-6-methoxy-α-methyl-, hydrochloride, (αS,5α,7α)-

Systematic Name

English

Code System Code Type Description

FDA UNII

ZJ6Q3WB4RJ

Created by admin on Sat Dec 16 18:30:14 UTC 2023 , Edited by admin on Sat Dec 16 18:30:14 UTC 2023

PRIMARY

PUBCHEM

166177205

Created by admin on Sat Dec 16 18:30:14 UTC 2023 , Edited by admin on Sat Dec 16 18:30:14 UTC 2023

PRIMARY

CAS

209963-02-0

Created by admin on Sat Dec 16 18:30:14 UTC 2023 , Edited by admin on Sat Dec 16 18:30:14 UTC 2023

PRIMARY

Related Record Type Details


					7E53B4O073

NORBUPRENORPHINE

PARENT -> SALT/SOLVATE

Amount: