[22-hydroxy-1,2,6,6,10,19-hexamethyl-16-oxo-7-[3,4,5-trihydroxy-6-(hydroxymethyl)oxan-2-yl]oxy-21-oxahexacyclo[12.11.0.02,11.05,10.015,23.018,23]pentacos-14-en-8-yl] acetate (CHEBI:212727)

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CHEBI:212727 - [22-hydroxy-1,2,6,6,10,19-hexamethyl-16-oxo-7-[3,4,5-trihydroxy-6-(hydroxymethyl)oxan-2-yl]oxy-21-oxahexacyclo[12.11.0.02,11.05,10.015,23.018,23]pentacos-14-en-8-yl] acetate

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ChEBI ID	CHEBI:212727
ChEBI Name	[22-hydroxy-1,2,6,6,10,19-hexamethyl-16-oxo-7-[3,4,5-trihydroxy-6-(hydroxymethyl)oxan-2-yl]oxy-21-oxahexacyclo[12.11.0.02,11.05,10.015,23.018,23]pentacos-14-en-8-yl] acetate
Stars
Submitter	MetaboLights
Downloads	Molfile

Formula	C38H58O11
Net Charge	0
Average Mass	690.871
Monoisotopic Mass	690.39791
SMILES	CC(=O)OC1CC2(C)C(CCC3(C)C2CCC2=C4C(=O)CC5C(C)COC(O)C45CCC23C)C(C)(C)C1OC1OC(CO)C(O)C(O)C1O
InChI	InChI=1S/C38H58O11/c1-18-17-46-33(45)38-13-12-36(6)20(27(38)22(41)14-21(18)38)8-9-26-35(5)15-23(47-19(2)40)31(34(3,4)25(35)10-11-37(26,36)7)49-32-30(44)29(43)28(42)24(16-39)48-32/h18,21,23-26,28-33,39,42-45H,8-17H2,1-7H3
InChIKey	PZQDGCARUUOFKS-UHFFFAOYSA-N

Species of Metabolite	Component	Source	Comments
Striaticonidium cinctum (ncbitaxon:1860054)	-	PubMed (15745112)

ChEBI Ontology

Outgoing Relation(s)
	[22-hydroxy-1,2,6,6,10,19-hexamethyl-16-oxo-7-[3,4,5-trihydroxy-6-(hydroxymethyl)oxan-2-yl]oxy-21-oxahexacyclo[12.11.0.02,11.05,10.015,23.018,23]pentacos-14-en-8-yl] acetate (CHEBI:212727) is a diterpene glycoside (CHEBI:71939)

IUPAC Name
[22-hydroxy-1,2,6,6,10,19-hexamethyl-16-oxo-7-[3,4,5-trihydroxy-6-(hydroxymethyl)oxan-2-yl]oxy-21-oxahexacyclo[12.11.0.02,11.05,10.015,23.018,23]pentacos-14-en-8-yl] acetate

Manual Xrefs	Databases
7985957	ChemSpider