(3AS,4R,9BR)-2,2-DIFLUORO-4-(4-HYDROXYPHENYL)-1,2,3,3A,4,9B-HEXAHYDROCYCLOPENTA[C]CHROMEN-8-OL (CHEBI:47375)

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CHEBI:47375 - (3AS,4R,9BR)-2,2-DIFLUORO-4-(4-HYDROXYPHENYL)-1,2,3,3A,4,9B-HEXAHYDROCYCLOPENTA[C]CHROMEN-8-OL

Default Structure

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ChEBI ID	CHEBI:47375
ChEBI Name	(3AS,4R,9BR)-2,2-DIFLUORO-4-(4-HYDROXYPHENYL)-1,2,3,3A,4,9B-HEXAHYDROCYCLOPENTA[C]CHROMEN-8-OL
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Last Modified	17 October 2009
Downloads	Molfile

Formula	C18H16F2O3
Net Charge	0
Average Mass	318.319
Monoisotopic Mass	318.10675
SMILES	[H]Oc1c([H])c([H])c([C@]2([H])Oc3c([H])c([H])c(O[H])c([H])c3[C@]3([H])C([H])([H])C(F)(F)C([H])([H])[C@]23[H])c([H])c1[H]
InChI	InChI=1S/C18H16F2O3/c19-18(20)8-14-13-7-12(22)5-6-16(13)23-17(15(14)9-18)10-1-3-11(21)4-2-10/h1-7,14-15,17,21-22H,8-9H2/t14-,15-,17-/m0/s1
InChIKey	QJSMFUTULGSHNQ-ZOBUZTSGSA-N

ChEBI Ontology

Outgoing Relation(s)
	(3AS,4R,9BR)-2,2-DIFLUORO-4-(4-HYDROXYPHENYL)-1,2,3,3A,4,9B-HEXAHYDROCYCLOPENTA[C]CHROMEN-8-OL (CHEBI:47375) is a unclassifieds (CHEBI:27189)

Synonyms	Source
(3aS,4R,9bR)-2,2-difluoro-4-(4-hydroxyphenyl)-1,2,3,3a,4,9b-hexahydrocyclopenta[c]chromen-8-ol	PDBeChem
(3AS,4R,9BR)-2,2-DIFLUORO-4-(4-HYDROXYPHENYL)-1,2,3,3A,4,9B-HEXAHYDROCYCLOPENTA[C]CHROMEN-8-OL	PDBeChem

Manual Xrefs	Databases
DC8	PDBeChem