Niranthin

Details

Stereochemistry	RACEMIC
Molecular Formula	C24H32O7
Molecular Weight	432.5067
Optical Activity	( + / - )
Defined Stereocenters	2 / 2
E/Z Centers	0
Charge	0

SHOW SMILES / InChI

Structure Search

SMILES

COC[C@@H](CC1=CC(OC)=C(OC)C=C1)[C@@H](COC)CC2=CC3=C(OCO3)C(OC)=C2

InChI

InChIKey=RCFGIEPQSDGMJJ-RTBURBONSA-N

InChI=1S/C24H32O7/c1-25-13-18(8-16-6-7-20(27-3)21(10-16)28-4)19(14-26-2)9-17-11-22(29-5)24-23(12-17)30-15-31-24/h6-7,10-12,18-19H,8-9,13-15H2,1-5H3/t18-,19-/m1/s1

HIDE SMILES / InChI

Molecular Formula	C24H32O7
Molecular Weight	432.5067
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 `Sat Dec 16 14:16:35 UTC 2023` Edited by `admin` on `Sat Dec 16 14:16:35 UTC 2023`
Record UNII	25M3G3LTF8
Record Status	`Validated (UNII)`
Record Version

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Name

Type

Language

Niranthin

Common Name

English

rel-6-[(2R,3R)-4-(3,4-Dimethoxyphenyl)-2,3-bis(methoxymethyl)butyl]-4-methoxy-1,3-benzodioxole

Systematic Name

English

1,3-Benzodioxole, 6-[4-(3,4-dimethoxyphenyl)-2,3-bis(methoxymethyl)butyl]-4-methoxy-, (R*,R*)-

Systematic Name

English

1,3-Benzodioxole, 6-[(2R,3R)-4-(3,4-dimethoxyphenyl)-2,3-bis(methoxymethyl)butyl]-4-methoxy-, rel-

Systematic Name

English

Code System Code Type Description

PUBCHEM

11575632

Created by admin on Sat Dec 16 14:16:35 UTC 2023 , Edited by admin on Sat Dec 16 14:16:35 UTC 2023

PRIMARY

EPA CompTox

DTXSID601318707

Created by admin on Sat Dec 16 14:16:35 UTC 2023 , Edited by admin on Sat Dec 16 14:16:35 UTC 2023

PRIMARY

CAS

50656-77-4

Created by admin on Sat Dec 16 14:16:35 UTC 2023 , Edited by admin on Sat Dec 16 14:16:35 UTC 2023

PRIMARY

FDA UNII

25M3G3LTF8

Created by admin on Sat Dec 16 14:16:35 UTC 2023 , Edited by admin on Sat Dec 16 14:16:35 UTC 2023

PRIMARY

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