N-docosanoyl-1-O-beta-D-glucosyl-15-methylhexadecasphing-4-enine (CHEBI:71105)

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CHEBI:71105 - N-docosanoyl-1-O-β-D-glucosyl-15-methylhexadecasphing-4-enine

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ChEBI ID	CHEBI:71105
ChEBI Name	N-docosanoyl-1-O-β-D-glucosyl-15-methylhexadecasphing-4-enine
Stars
ASCII Name	N-docosanoyl-1-O-beta-D-glucosyl-15-methylhexadecasphing-4-enine
Definition	An N-acyl-1-O-β-D-glucosyl-15-methylhexadecasphing-4-enine in which the acyl group has 22 carbons and 0 double bonds.
Last Modified	23 November 2012
Submitter	AnneNiknejad
Downloads	Molfile

Formula	C45H87NO8
Net Charge	0
Average Mass	770.190
Monoisotopic Mass	769.64317
SMILES	CCCCCCCCCCCCCCCCCCCCCC(=O)N[C@@H](CO[C@@H]1O[C@H](CO)[C@@H](O)[C@H](O)[C@H]1O)[C@H](O)/C=C/CCCCCCCCCC(C)C
InChI	InChI=1S/C45H87NO8/c1-4-5-6-7-8-9-10-11-12-13-14-15-16-17-18-22-25-28-31-34-41(49)46-38(36-53-45-44(52)43(51)42(50)40(35-47)54-45)39(48)33-30-27-24-21-19-20-23-26-29-32-37(2)3/h30,33,37-40,42-45,47-48,50-52H,4-29,31-32,34-36H2,1-3H3,(H,46,49)/b33-30+/t38-,39+,40+,42+,43-,44+,45+/m0/s1
InChIKey	NUDHCKZTUPPOAH-IOKJWZEFSA-N

ChEBI Ontology

Outgoing Relation(s)
	N-docosanoyl-1-O-β-D-glucosyl-15-methylhexadecasphing-4-enine (CHEBI:71105) has functional parent 15-methylhexadecasphing-4-enine (CHEBI:70798)
	N-docosanoyl-1-O-β-D-glucosyl-15-methylhexadecasphing-4-enine (CHEBI:71105) is a N-acyl-1-O-β-D-glucosyl-15-methylhexadecasphing-4-enine (CHEBI:70815)