ISOTRILOBINE

Details

Stereochemistry	ABSOLUTE
Molecular Formula	C36H36N2O5
Molecular Weight	576.6814
Optical Activity	UNSPECIFIED
Defined Stereocenters	2 / 2
E/Z Centers	0
Charge	0

SHOW SMILES / InChI

Structure Search

SMILES

COC1=C2OC3=CC=C(C[C@@H]4N(C)CCC5=CC(OC)=C6OC7=C(OC6=C45)C=C8[C@H](CC(C=C1)=C2)N(C)CCC8=C7)C=C3

InChI

InChIKey=SVMNNRZZJAFEJM-NSOVKSMOSA-N

InChI=1S/C36H36N2O5/c1-37-13-11-23-18-31-32-20-26(23)27(37)16-22-7-10-29(39-3)30(17-22)41-25-8-5-21(6-9-25)15-28-34-24(12-14-38(28)2)19-33(40-4)35(42-31)36(34)43-32/h5-10,17-20,27-28H,11-16H2,1-4H3/t27-,28-/m0/s1

HIDE SMILES / InChI

Molecular Formula	C36H36N2O5
Molecular Weight	576.6814
Charge	0
Count

Stereochemistry	ABSOLUTE
Additional Stereochemistry	No
Defined Stereocenters	2 / 2
E/Z Centers	0
Optical Activity	UNSPECIFIED

Approval Year

Substance Class	Chemical Created by `admin` on `Wed Apr 02 12:07:53 GMT 2025` Edited by `admin` on `Wed Apr 02 12:07:53 GMT 2025`
Record UNII	WIB21F188O
Record Status	`Validated (UNII)`
Record Version

Download

Name

Type

Language

(+)-ISOTRILOBINE

Preferred Name

English

ISOTRILOBINE

Common Name

English

2H-22,26-EPOXY-1,24:12,15-DIETHENO-6,10-METHENO-16H-PYRIDO(2',3':17,18)(1,10)DIOXACYCLOEICOSINO(2,3,4-IJ)ISOQUINOLINE, 3,4,4A,5,16A,17,18,19-OCTAHYDRO-9,21-DIMETHOXY-4,17-DIMETHYL-, (4AS,16AS)-

Systematic Name

English

N,O-DIMETHYLCOCSOLINE

Common Name

English

ISOTRILOBIN

Common Name

English

HOMOTRILOBIN

Common Name

English

ISOTRILOBINE [MI]

Common Name

English

HOMOTRILOBINE

Common Name

English

N-METHYLTRILOBINE

Common Name

English

Code System Code Type Description

EPA CompTox

DTXSID90949070

Created by admin on Wed Apr 02 12:07:53 GMT 2025 , Edited by admin on Wed Apr 02 12:07:53 GMT 2025

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FDA UNII

WIB21F188O

Created by admin on Wed Apr 02 12:07:53 GMT 2025 , Edited by admin on Wed Apr 02 12:07:53 GMT 2025

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CAS

26195-62-0

Created by admin on Wed Apr 02 12:07:53 GMT 2025 , Edited by admin on Wed Apr 02 12:07:53 GMT 2025

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PUBCHEM

12310578

Created by admin on Wed Apr 02 12:07:53 GMT 2025 , Edited by admin on Wed Apr 02 12:07:53 GMT 2025

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