22-hydroxyramiferin (CHEBI:209341)

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CHEBI:209341 - 22-hydroxyramiferin

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ChEBI ID	CHEBI:209341
ChEBI Name	22-hydroxyramiferin
Stars
Submitter	MetaboLights
Downloads	Molfile

Formula	C31H40O5
Net Charge	0
Average Mass	492.656
Monoisotopic Mass	492.28757
SMILES	Cc1cc(O)cc2c1C[C@@H]1CC(C)(C)/C=C/C[C@@]3(C)Oc4c(O)c(O)cc(C)c4C[C@@H]3CC[C@]1(C)O2
InChI	InChI=1S/C31H40O5/c1-18-12-22(32)16-26-23(18)15-21-17-29(3,4)9-7-10-30(5)20(8-11-31(21,6)35-26)14-24-19(2)13-25(33)27(34)28(24)36-30/h7,9,12-13,16,20-21,32-34H,8,10-11,14-15,17H2,1-6H3/b9-7+/t20-,21+,30+,31-/m0/s1
InChIKey	YENSTAHHYOVSMR-DKIYHXGZSA-N

Species of Metabolite	Component	Source	Comments
Neosetophoma (ncbitaxon:798068)	-	PubMed (30620608)

ChEBI Ontology

Outgoing Relation(s)
	22-hydroxyramiferin (CHEBI:209341) is a 1-benzopyran (CHEBI:38443)

IUPAC Name
(1S,4S,13S,16E,19R)-4,10,15,15,19,25-hexamethyl-5,20-dioxapentacyclo[17.8.0.04,13.06,11.021,26]heptacosa-6(11),7,9,16,21(26),22,24-heptaene-8,22,23-triol