Hernangerine, (+)-

Details

Stereochemistry	ABSOLUTE
Molecular Formula	C18H17NO4
Molecular Weight	311.3319
Optical Activity	( + )
Defined Stereocenters	1 / 1
E/Z Centers	0
Charge	0

SHOW SMILES / InChI

Structure Search

SMILES

COC1=C2C(C[C@@H]3NCCC4=CC5=C(OCO5)C2=C34)=CC=C1O

InChI

InChIKey=CFUKKPQRQGCLAT-NSHDSACASA-N

InChI=1S/C18H17NO4/c1-21-17-12(20)3-2-9-6-11-14-10(4-5-19-11)7-13-18(23-8-22-13)16(14)15(9)17/h2-3,7,11,19-20H,4-6,8H2,1H3/t11-/m0/s1

HIDE SMILES / InChI

Molecular Formula	C18H17NO4
Molecular Weight	311.3319
Charge	0
Count

Stereochemistry	ABSOLUTE
Additional Stereochemistry	No
Defined Stereocenters	1 / 1
E/Z Centers	0
Optical Activity	UNSPECIFIED

Approval Year

Substance Class	Chemical Created by `admin` on `Mon Mar 31 20:12:12 GMT 2025` Edited by `admin` on `Mon Mar 31 20:12:12 GMT 2025`
Record UNII	A8TEX5Y4UN
Record Status	`Validated (UNII)`
Record Version

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Name

Type

Language

(+)-NANDIGERINE

Preferred Name

English

Hernangerine, (+)-

Common Name

English

L-NANDIGERINE

Common Name

English

5H-BENZO(G)-1,3-BENZODIOXOLO(6,5,4-DE)QUINOLIN-11-OL, 6,7,7A,8-TETRAHYDRO-12-METHOXY-, (7AS)-

Systematic Name

English

6A.ALPHA.-NORAPORPHIN-10-OL, 11-METHOXY-1,2-(METHYLENEDIOXY)-

Common Name

English

5H-BENZO(G)-1,3-BENZODIOXOLO(6,5,4-DE)QUINOLIN-11-OL, 6,7,7A,8-TETRAHYDRO-12-METHOXY-, (7AS)- 2-PROPENOIC ACID, METHYL ESTER, POLYMER WITH 1,2-ETHANEDIAMINE

Common Name

English

Nandigerine, (+)-

Common Name

English

(12S)-18-methoxy-3,5-dioxa-11-azapentacyclo[10.7.1.0{2,6}.0{8,20}.0{14,19}]icosa-1(20),2(6),7,14(19),15,17-hexaen-17-ol

Systematic Name

English

5H-BENZO(G)-1,3-BENZODIOXOLO(6,5,4-DE)QUINOLIN-11-OL, 6,7,7A,8-TETRAHYDRO-12-METHOXY-, (S)-

Systematic Name

English

NANDIGERINE

Common Name

English

Hernangerine

Common Name

English

Code System Code Type Description

PUBCHEM

497804

Created by admin on Mon Mar 31 20:12:12 GMT 2025 , Edited by admin on Mon Mar 31 20:12:12 GMT 2025

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EPA CompTox

DTXSID90185416

Created by admin on Mon Mar 31 20:12:12 GMT 2025 , Edited by admin on Mon Mar 31 20:12:12 GMT 2025

PRIMARY

CAS

31520-97-5

Created by admin on Mon Mar 31 20:12:12 GMT 2025 , Edited by admin on Mon Mar 31 20:12:12 GMT 2025

PRIMARY

FDA UNII

A8TEX5Y4UN

Created by admin on Mon Mar 31 20:12:12 GMT 2025 , Edited by admin on Mon Mar 31 20:12:12 GMT 2025

PRIMARY

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