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2'-hydroxy-2-oxospirilloxanthin

Properties

Image

Occurences in reactions

MNX_ID

MNXM147737

	#reac
in my sandbox	0
in MNXref (generic)	6
in models (compartimentalized)	0

formula

C₄₂H₅₈O₄

charge

mass

626.43351

reference

chebi:91229

InChIKey

UMEYQXNKNUVLNE-YDDLGYPNSA-N

InChI

InChI=1S/C42H58O4/c1-33(21-15-23-35(3)25-17-27-37(5)29-31-39(43)41(7,8)45-11)19-13-14-20-34(2)22-16-24-36(4)26-18-28-38(6)30-32-40(44)42(9,10)46-12/h13-32,39,43H,1-12H3/b14-13+,21-15+,22-16+,25-17+,26-18+,31-29+,32-30+,33-19+,34-20+,35-23+,36-24+,37-27+,38-28+

SMILES

COC(C)(C)C(=O)/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=C(C)/C=C/C(O)C(C)(C)OC

Parent-child relations graph

Deprecated MNXref IDs graph

Similar chemical compounds in external resources
Identifier	Description
CHEBI:91229 chebi:91229	2'-hydroxy-2-oxospirilloxanthin (3E,3'E)-2'-hydroxy-1,1'-dimethoxy-3,3',4,4'-tetradehydro-1,1',2,2'-tetrahydro-psi,psi-caroten-2-one 2-hydroxy-2'-oxospirilloxanthin
seed.compound:cpd31733 seedM:cpd31733	2'-hydroxy-2-ketospirilloxanthin 2'-hydroxy-2-oxospirilloxanthin
metacyc.compound:CPD-16863 metacycM:CPD-16863	2'-hydroxy-2-oxospirilloxanthin 2'-hydroxy-2-ketospirilloxanthin
seedM:M_cpd31733	secondary/obsolete/fantasy identifier