BUPHANITINE NITRATE

Details

Stereochemistry	ABSOLUTE
Molecular Formula	C17H21NO5.HNO3
Molecular Weight	382.3652
Optical Activity	UNSPECIFIED
Defined Stereocenters	5 / 5
E/Z Centers	0
Charge	0

SHOW SMILES / InChI

Structure Search

SMILES

O[N+]([O-])=O.COC1=C2C[N@@]3CC[C@@]4([C@H]3C[C@@H](O)C[C@H]4O)C2=CC5=C1OCO5

InChI

InChIKey=BJMBFEQCSMWVPS-CIIYBQJVSA-N

InChI=1S/C17H21NO5.HNO3/c1-21-15-10-7-18-3-2-17(13(18)4-9(19)5-14(17)20)11(10)6-12-16(15)23-8-22-12;2-1(3)4/h6,9,13-14,19-20H,2-5,7-8H2,1H3;(H,2,3,4)/t9-,13-,14-,17+;/m1./s1

HIDE SMILES / InChI

Molecular Formula	HNO3
Molecular Weight	63.0128
Charge	0
Count

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

Molecular Formula	C17H21NO5
Molecular Weight	319.3523
Charge	0
Count

Stereochemistry	ABSOLUTE
Additional Stereochemistry	No
Defined Stereocenters	4 / 4
E/Z Centers	0
Optical Activity	UNSPECIFIED

Approval Year

Substance Class	Chemical Created by `admin` on `Mon Mar 31 23:33:05 GMT 2025` Edited by `admin` on `Mon Mar 31 23:33:05 GMT 2025`
Record UNII	F650R2382W
Record Status	`Validated (UNII)`
Record Version

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Name

Type

Language

BUPHANITINE NITRATE

Common Name

English

BUPHANITINE NITRATE [MI]

Preferred Name

English

(1R,3R,4AR,5S,11BS)-7-METHOXY-1,2,3,4,4A,6-HEXAHYDRO-5,11B-ETHANO(1,3)DIOXOLO(4,5-J)PHENANTHRIDINE-1,3-DIOL NITRATE

Systematic Name

English

Code System Code Type Description

MERCK INDEX

m2767

Created by admin on Mon Mar 31 23:33:05 GMT 2025 , Edited by admin on Mon Mar 31 23:33:05 GMT 2025

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Merck Index

PUBCHEM

76971616

Created by admin on Mon Mar 31 23:33:05 GMT 2025 , Edited by admin on Mon Mar 31 23:33:05 GMT 2025

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FDA UNII

F650R2382W

Created by admin on Mon Mar 31 23:33:05 GMT 2025 , Edited by admin on Mon Mar 31 23:33:05 GMT 2025

PRIMARY