SAMANDARINE HYDROCHLORIDE

Details

Stereochemistry	ABSOLUTE
Molecular Formula	C19H31NO2.ClH
Molecular Weight	341.916
Optical Activity	UNSPECIFIED
Defined Stereocenters	9 / 9
E/Z Centers	0
Charge	0

SHOW SMILES / InChI

Structure Search

SMILES

Cl.C[C@@]12C[C@@H](O)C[C@H]1[C@@H]3CC[C@@H]4C[C@H]5NC[C@H](O5)[C@]4(C)[C@H]3CC2

InChI

InChIKey=JSCFULNKKDTUNE-AQOXFJSPSA-N

InChI=1S/C19H31NO2.ClH/c1-18-6-5-14-13(15(18)8-12(21)9-18)4-3-11-7-17-20-10-16(22-17)19(11,14)2;/h11-17,20-21H,3-10H2,1-2H3;1H/t11-,12+,13-,14+,15+,16+,17+,18-,19+;/m1./s1

HIDE SMILES / InChI

Molecular Formula	C19H31NO2
Molecular Weight	305.4549
Charge	0
Count

Stereochemistry	ABSOLUTE
Additional Stereochemistry	No
Defined Stereocenters	9 / 9
E/Z Centers	0
Optical Activity	UNSPECIFIED

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

Approval Year

PubMed

Title	Date	PubMed
Variability of alkaloids in the skin secretion of the European fire salamander (Salamandra salamadra terrestris).	2005-04	15777956

Substance Class	Chemical Created by `admin` on `Mon Mar 31 21:59:22 GMT 2025` Edited by `admin` on `Mon Mar 31 21:59:22 GMT 2025`
Record UNII	6I3GJM97RJ
Record Status	`Validated (UNII)`
Record Version

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Name

Type

Language

1.ALPHA.,4.ALPHA.,5.BETA.,16.BETA.)-1,4-EPOXY-3-AZA-A-HOMOANDROSTAN-16-OL, HYDROCHLORIDE

Preferred Name

English

SAMANDARINE HYDROCHLORIDE

Common Name

English

SAMANDARINE HYDROCHLORIDE [MI]

Common Name

English

2,5-EPOXYCYCLOPENTA(5,6)NAPHTH(1,2-D)AZEPIN-9-OL, OCTADECAHYDRO-5A,7A-DIMETHYL-, HYDROCHLORIDE (1:1), (2S,5R,5AS,5BS,7AR,9S,10AS,10BS,12AR)-

Systematic Name

English

Code System Code Type Description

PUBCHEM

90478794

Created by admin on Mon Mar 31 21:59:22 GMT 2025 , Edited by admin on Mon Mar 31 21:59:22 GMT 2025

PRIMARY

CAS

619326-02-2

Created by admin on Mon Mar 31 21:59:22 GMT 2025 , Edited by admin on Mon Mar 31 21:59:22 GMT 2025

PRIMARY

MERCK INDEX

m9753

Created by admin on Mon Mar 31 21:59:22 GMT 2025 , Edited by admin on Mon Mar 31 21:59:22 GMT 2025

PRIMARY

Merck Index

FDA UNII

6I3GJM97RJ

Created by admin on Mon Mar 31 21:59:22 GMT 2025 , Edited by admin on Mon Mar 31 21:59:22 GMT 2025

PRIMARY

Related Record Type Details


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SAMANDARINE

PARENT -> SALT/SOLVATE