N-METHYLNALTRINDOLE HYDROCHLORIDE

Details

Stereochemistry	ABSOLUTE
Molecular Formula	C27H28N2O3.ClH
Molecular Weight	464.984
Optical Activity	UNSPECIFIED
Defined Stereocenters	4 / 4
E/Z Centers	0
Charge	0

SHOW SMILES / InChI

Structure of N-METHYLNALTRINDOLE HYDROCHLORIDE

Structure Search

SMILES

Cl.[H][C@@]12OC3=C4C(C[C@H]5N(CC6CC6)CC[C@@]14[C@@]5(O)CC7=C2N(C)C8=C7C=CC=C8)=CC=C3O

InChI

InChIKey=ZSYCGYUGBMEGCK-ZHXLFDHXSA-N

InChI=1S/C27H28N2O3.ClH/c1-28-19-5-3-2-4-17(19)18-13-27(31)21-12-16-8-9-20(30)24-22(16)26(27,25(32-24)23(18)28)10-11-29(21)14-15-6-7-15;/h2-5,8-9,15,21,25,30-31H,6-7,10-14H2,1H3;1H/t21-,25+,26+,27-;/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	C27H28N2O3
Molecular Weight	428.5228
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 `Sat Dec 16 08:54:15 GMT 2023` Edited by `admin` on `Sat Dec 16 08:54:15 GMT 2023`
Record UNII	8QDL68Z0IR
Record Status	`Validated (UNII)`
Record Version

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Name

Type

Language

N-METHYLNALTRINDOLE HYDROCHLORIDE

Common Name

English

4,8-METHANOBENZOFURO(2,3-A)PYRIDO(4,3-B)CARBAZOLE-1,8A(9H)-DIOL, 7-(CYCLOPROPYLMETHYL)-5,6,7,8,14,14B-HEXAHYDRO-14-METHYL-, HYDROCHLORIDE (1:1), (4BS,8R,8AS,14BR)-

Systematic Name

English

Code System Code Type Description

CAS

111469-85-3

Created by admin on Sat Dec 16 08:54:16 GMT 2023 , Edited by admin on Sat Dec 16 08:54:16 GMT 2023

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PUBCHEM

72941648

Created by admin on Sat Dec 16 08:54:16 GMT 2023 , Edited by admin on Sat Dec 16 08:54:16 GMT 2023

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FDA UNII

8QDL68Z0IR

Created by admin on Sat Dec 16 08:54:16 GMT 2023 , Edited by admin on Sat Dec 16 08:54:16 GMT 2023

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