N-[(1S)-2R-hydroxy-1-[[(3-O-sulfo-β-D-galactopyranosyl)oxy]methyl]-3E-heptadecen-1-yl]-15Z-tetracosenamide

Details

Stereochemistry	ABSOLUTE
Molecular Formula	C48H91NO11S
Molecular Weight	890.301
Optical Activity	( + )
Defined Stereocenters	7 / 7
E/Z Centers	2
Charge	0

SHOW SMILES / InChI

Structure of N-[(1S)-2R-hydroxy-1-[[(3-O-sulfo-β-D-galactopyranosyl)oxy]methyl]-3E-heptadecen-1-yl]-15Z-tetracosenamide

Structure Search

SMILES

CCCCCCCCCCCCC\C=C\[C@@H](O)[C@H](CO[C@@H]1O[C@H](CO)[C@H](O)[C@H](OS(O)(=O)=O)[C@H]1O)NC(=O)CCCCCCCCCCCCC\C=C/CCCCCCCC

InChI

InChIKey=ZZQWQNAZXFNSEP-JCOQVFCVSA-N

InChI=1S/C48H91NO11S/c1-3-5-7-9-11-13-15-17-18-19-20-21-22-23-24-26-28-30-32-34-36-38-44(52)49-41(42(51)37-35-33-31-29-27-25-16-14-12-10-8-6-4-2)40-58-48-46(54)47(60-61(55,56)57)45(53)43(39-50)59-48/h17-18,35,37,41-43,45-48,50-51,53-54H,3-16,19-34,36,38-40H2,1-2H3,(H,49,52)(H,55,56,57)/b18-17-,37-35+/t41-,42+,43+,45-,46+,47-,48+/m0/s1

HIDE SMILES / InChI

Molecular Formula	C48H91NO11S
Molecular Weight	890.301
Charge	0
Count

Stereochemistry	ABSOLUTE
Additional Stereochemistry	No
Defined Stereocenters	7 / 7
E/Z Centers	2
Optical Activity	UNSPECIFIED

Approval Year

Substance Class	Chemical Created by `admin` on `Sat Dec 16 15:20:23 GMT 2023` Edited by `admin` on `Sat Dec 16 15:20:23 GMT 2023`
Record UNII	LH5A9ZGN2U
Record Status	`Validated (UNII)`
Record Version

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Name

Type

Language

N-[(1S)-2R-hydroxy-1-[[(3-O-sulfo-β-D-galactopyranosyl)oxy]methyl]-3E-heptadecen-1-yl]-15Z-tetracosenamide

Systematic Name

English

(15Z)-N-[(1S,2R,3E)-2-Hydroxy-1-[[(3-O-sulfo-β-D-galactopyranosyl)oxy]methyl]-3-heptadecen-1-yl]-15-tetracosenamide

Systematic Name

English

C24:1 3'-sulfo Galactosylceramide (d18:1/24:1(15Z))

Common Name

English

N-Tetracosenoyl-(cis-15)-sulfatide

Common Name

English

[(2R,3R,4S,5S,6R)-3,5-dihydroxy-2-{[(2S,3R,4E)-3-hydroxy-2-[(15Z)-tetracos-15-enamido]octadec-4-en-1-yl]oxy}-6-(hydroxymethyl)oxan-4-yl]oxidanesulfonic acid

Systematic Name

English

15-Tetracosenamide, N-[(1S,2R,3E)-2-hydroxy-1-[[(3-O-sulfo-β-D-galactopyranosyl)oxy]methyl]-3-heptadecen-1-yl]-, (15Z)-

Systematic Name

English

Code System Code Type Description

PUBCHEM

5459361

Created by admin on Sat Dec 16 15:20:24 GMT 2023 , Edited by admin on Sat Dec 16 15:20:24 GMT 2023

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EPA CompTox

DTXSID901106551

Created by admin on Sat Dec 16 15:20:23 GMT 2023 , Edited by admin on Sat Dec 16 15:20:23 GMT 2023

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FDA UNII

LH5A9ZGN2U

Created by admin on Sat Dec 16 15:20:24 GMT 2023 , Edited by admin on Sat Dec 16 15:20:24 GMT 2023

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CAS

151057-28-2

Created by admin on Sat Dec 16 15:20:23 GMT 2023 , Edited by admin on Sat Dec 16 15:20:23 GMT 2023

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