(2E,5R,8E,10E,12E,14E,16E,18E,20E,22E,24E,26E,28E,32R,34E)-2,8,12,16,21,25,29,35-Octamethyl-5,32-bis(prop-1-en-2-yl)hexatriaconta-2,8,10,12,14,16,18,20,22,24,26,28,34-tridecaene-1,36-diol (CHEBI:181406)

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CHEBI:181406 - (2E,5R,8E,10E,12E,14E,16E,18E,20E,22E,24E,26E,28E,32R,34E)-2,8,12,16,21,25,29,35-Octamethyl-5,32-bis(prop-1-en-2-yl)hexatriaconta-2,8,10,12,14,16,18,20,22,24,26,28,34-tridecaene-1,36-diol

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ChEBI ID	CHEBI:181406
ChEBI Name	(2E,5R,8E,10E,12E,14E,16E,18E,20E,22E,24E,26E,28E,32R,34E)-2,8,12,16,21,25,29,35-Octamethyl-5,32-bis(prop-1-en-2-yl)hexatriaconta-2,8,10,12,14,16,18,20,22,24,26,28,34-tridecaene-1,36-diol
Stars
Submitter	MetaboLights
Downloads	Molfile

Formula	C50H72O2
Net Charge	0
Average Mass	705.124
Monoisotopic Mass	704.55323
SMILES	C=C(C)[C@@H](C/C=C(\C)CO)CC/C(C)=C/C=C/C(C)=C/C=C/C(C)=C/C=C/C=C(C)/C=C/C=C(C)/C=C/C=C(\C)CC[C@H](C/C=C(\C)CO)C(=C)C
InChI	InChI=1S/C50H72O2/c1-39(2)49(35-31-47(11)37-51)33-29-45(9)27-17-25-43(7)23-15-21-41(5)19-13-14-20-42(6)22-16-24-44(8)26-18-28-46(10)30-34-50(40(3)4)36-32-48(12)38-52/h13-28,31-32,49-52H,1,3,29-30,33-38H2,2,4-12H3/b14-13+,21-15+,22-16+,25-17+,26-18+,41-19+,42-20+,43-23+,44-24+,45-27+,46-28+,47-31+,48-32+/t49-,50-/m1/s1
InChIKey	AYPYRCXQBMEHMB-MHYNTQJQSA-N

ChEBI Ontology

Outgoing Relation(s)
	(2E,5R,8E,10E,12E,14E,16E,18E,20E,22E,24E,26E,28E,32R,34E)-2,8,12,16,21,25,29,35-Octamethyl-5,32-bis(prop-1-en-2-yl)hexatriaconta-2,8,10,12,14,16,18,20,22,24,26,28,34-tridecaene-1,36-diol (CHEBI:181406) is a xanthophyll (CHEBI:27325)

IUPAC Name
(2E,5R,8E,10E,12E,14E,16E,18E,20E,22E,24E,26E,28E,32R,34E)-2,8,12,16,21,25,29,35-octamethyl-5,32-bis(prop-1-en-2-yl)hexatriaconta-2,8,10,12,14,16,18,20,22,24,26,28,34-tridecaene-1,36-diol

Manual Xrefs	Databases
C22057	KEGG COMPOUND