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2-O-sulfo-2'-O-hexadecanoyl-alpha,alpha-trehalose

Properties

Image

Occurences in reactions

MNX_ID

MNXM82193

	#reac
in my sandbox	0
in MNXref (generic)	5
in models (compartimentalized)	1

formula

C₂₈H₅₁O₁₅S

charge

-1

mass

659.29542

reference

chebi:60092

InChIKey

AKFSXZFFUZRYPP-FJUFGMPQSA-M

InChI

InChI=1S/C28H52O15S/c1-2-3-4-5-6-7-8-9-10-11-12-13-14-15-20(31)41-25-23(34)21(32)18(16-29)39-27(25)42-28-26(43-44(36,37)38)24(35)22(33)19(17-30)40-28/h18-19,21-30,32-35H,2-17H2,1H3,(H,36,37,38)/p-1/t18-,19-,21-,22-,23+,24+,25-,26-,27-,28-/m1/s1

SMILES

CCCCCCCCCCCCCCCC(=O)O[C@@H]1[C@@H](O)[C@H](O)[C@@H](CO)O[C@@H]1O[C@H]1O[C@H](CO)[C@@H](O)[C@H](O)[C@H]1OS(=O)(=O)[O-]

Parent-child relations graph

Deprecated MNXref IDs graph

Similar chemical compounds in external resources
Identifier	Description
CHEBI:60092 chebi:60092	2-O-sulfo-2'-O-hexadecanoyl-alpha,alpha-trehalose 2-O-sulfonato-alpha-D-glucopyranosyl 2-O-hexadecanoyl-alpha-D-glucopyranoside SL659
metacyc.compound:CPD-18704 metacycM:CPD-18704 seed.compound:cpd34533 seedM:cpd34533	2'-palmitoyl-2-O-sulfo-alpha,alpha-trehalose 2'-palmitoyl-trehalose-2 sulfate SL659
kegg.compound:C22176 keggC:C22176	2-O-Sulfo-2'-palmitoyl-alpha,alpha-trehalose
sabiork.compound:31825 sabiorkM:31825	Trehalose 2-sulfate-2''-palmitate 2-O-Sulfo-2'-palmitoyl-alpha,alpha-trehalose SL659
keggC:M_C22176 seedM:M_cpd34533	secondary/obsolete/fantasy identifier