N-(NBD-AMINOHEXANOYL)-D-ERYTHRO-SPHINGOSINE

Details

Stereochemistry	ABSOLUTE
Molecular Formula	C30H49N5O6
Molecular Weight	575.74
Optical Activity	UNSPECIFIED
Defined Stereocenters	2 / 2
E/Z Centers	1
Charge	0

SHOW SMILES / InChI

Structure of N-(NBD-AMINOHEXANOYL)-D-ERYTHRO-SPHINGOSINE

Structure Search

SMILES

CCCCCCCCCCCCC\C=C\[C@@H](O)[C@H](CO)NC(=O)CCCCCNC1=CC=C(C2=NON=C12)[N+]([O-])=O

InChI

InChIKey=HZIRBXILQRLFIK-VPZZKNKNSA-N

InChI=1S/C30H49N5O6/c1-2-3-4-5-6-7-8-9-10-11-12-13-15-18-27(37)25(23-36)32-28(38)19-16-14-17-22-31-24-20-21-26(35(39)40)30-29(24)33-41-34-30/h15,18,20-21,25,27,31,36-37H,2-14,16-17,19,22-23H2,1H3,(H,32,38)/b18-15+/t25-,27+/m0/s1

HIDE SMILES / InChI

Molecular Formula	C30H49N5O6
Molecular Weight	575.74
Charge	0
Count

Stereochemistry	ABSOLUTE
Additional Stereochemistry	No
Defined Stereocenters	2 / 2
E/Z Centers	1
Optical Activity	UNSPECIFIED

Approval Year

Substance Class	Chemical Created by `admin` on `Sat Dec 16 11:07:08 GMT 2023` Edited by `admin` on `Sat Dec 16 11:07:08 GMT 2023`
Record UNII	39ZCU6EB2E
Record Status	`Validated (UNII)`
Record Version

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Name

Type

Language

N-(NBD-AMINOHEXANOYL)-D-ERYTHRO-SPHINGOSINE

Common Name

English

N-((1S,2R,3E)-2-HYDROXY-1-(HYDROXYMETHYL)-3-HEPTADECEN-1-YL)-6-((7-NITRO-2,1,3-BENZOXADIAZOL-4-YL)AMINO)HEXANAMIDE

Systematic Name

English

N-(6-((7-NITRO-2-1,3-BENZOXADIAZOL-4-YL)AMINO)HEXANOYL)-D-ERYTHRO-SPHINGOSINE

Common Name

English

NBD-C 6CER

Common Name

English

HEXANAMIDE, N-((1S,2R,3E)-2-HYDROXY-1-(HYDROXYMETHYL)-3-HEPTADECEN-1-YL)-6-((7-NITRO-2,1,3-BENZOXADIAZOL-4-YL)AMINO)-

Systematic Name

English

C-6 NBD CERAMIDE

Common Name

English

Code System Code Type Description

PUBCHEM

16219783