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CHEBI:192908 - Hydroxysintaxanthin 5,6-epoxide

Default Structure
ChEBI IDCHEBI:192908
ChEBI NameHydroxysintaxanthin 5,6-epoxide
Stars
SubmitterMetaboLights
DownloadsMolfile
FormulaC31H42O3
Net Charge0
Average Mass462.674
Monoisotopic Mass462.31340
SMILESCC(=O)/C(C)=C/C=C/C(C)=C/C=C\C=C(C)\C=C\C=C(C)/C=C/C12OC1(C)CC(O)CC2(C)C
InChIInChI=1S/C31H42O3/c1-23(13-9-10-14-24(2)17-12-18-26(4)27(5)32)15-11-16-25(3)19-20-31-29(6,7)21-28(33)22-30(31,8)34-31/h9-20,28,33H,21-22H2,1-8H3/b10-9-,15-11+,17-12+,20-19+,23-13+,24-14+,25-16-,26-18+
InChIKeyHPOMATRGLHSHPK-MBEKKZSISA-N
Species of MetaboliteComponentSourceComments
Cryptomeria (ncbitaxon:3368) needle (BTO:0000917) MetaboLights (MTBLS4099) Strain: Cryptomeria fortunei Hooibrenk
ChEBI Ontology
Outgoing Relation(s)
Hydroxysintaxanthin 5,6-epoxide (CHEBI:192908) is a triterpenoid (CHEBI:36615)
IUPAC Name 
(3E,5E,7E,9Z,11E,13E,15Z,17E)-18-(4-hydroxy-2,2,6-trimethyl-7-oxabicyclo[4.1.0]heptan-1-yl)-3,7,12,16-tetramethyloctadeca-3,5,7,9,11,13,15,17-octaen-2-one
Manual XrefsDatabases
35014743ChemSpider
HMDB0039086HMDB