(2R)-2-hydroxy-2-[(2S,3S,5R,6S)-2-hydroxy-6-[[(4R,5R,6R,7R,9S)-2-[(2R,3R,5S)-5-[(2R,5R)-5-[(2S,3S,5R,6S)-6-hydroxy-3,5,6-trimethyloxan-2-yl]oxolan-2-yl]-3-[(2S,5S,6R)-5-methoxy-6-methyloxan-2-yl]oxyoxolan-2-yl]-7-methoxy-2,4,6-trimethyl-1,10-dioxaspiro[4.5]decan-9-yl]methyl]-4-methoxy-3,5-dimethyloxan-2-yl]acetic acid (CHEBI:223690)

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CHEBI:223690 - (2R)-2-hydroxy-2-[(2S,3S,5R,6S)-2-hydroxy-6-[[(4R,5R,6R,7R,9S)-2-[(2R,3R,5S)-5-[(2R,5R)-5-[(2S,3S,5R,6S)-6-hydroxy-3,5,6-trimethyloxan-2-yl]oxolan-2-yl]-3-[(2S,5S,6R)-5-methoxy-6-methyloxan-2-yl]oxyoxolan-2-yl]-7-methoxy-2,4,6-trimethyl-1,10-dioxaspiro[4.5]decan-9-yl]methyl]-4-methoxy-3,5-dimethyloxan-2-yl]acetic acid

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ChEBI ID	CHEBI:223690
ChEBI Name	(2R)-2-hydroxy-2-[(2S,3S,5R,6S)-2-hydroxy-6-[[(4R,5R,6R,7R,9S)-2-[(2R,3R,5S)-5-[(2R,5R)-5-[(2S,3S,5R,6S)-6-hydroxy-3,5,6-trimethyloxan-2-yl]oxolan-2-yl]-3-[(2S,5S,6R)-5-methoxy-6-methyloxan-2-yl]oxyoxolan-2-yl]-7-methoxy-2,4,6-trimethyl-1,10-dioxaspiro[4.5]decan-9-yl]methyl]-4-methoxy-3,5-dimethyloxan-2-yl]acetic acid
Stars
Submitter	MetaboLights
Downloads	Molfile

Formula	C46H78O16
Net Charge	0
Average Mass	887.114
Monoisotopic Mass	886.52899
SMILES	COC1[C@H](C)[C@H](C[C@@H]2C[C@@H](OC)[C@@H](C)[C@]3(O2)OC(C)([C@@H]2O[C@H]([C@H]4CC[C@H]([C@H]5O[C@](C)(O)[C@H](C)C[C@@H]5C)O4)C[C@H]2O[C@H]2CC[C@H](OC)[C@@H](C)O2)C[C@H]3C)O[C@](O)([C@@H](O)C(=O)O)[C@H]1C
InChI	InChI=1S/C46H78O16/c1-22-17-23(2)44(9,50)61-38(22)32-14-13-31(56-32)35-20-36(57-37-16-15-30(52-10)28(7)55-37)41(58-35)43(8)21-24(3)46(62-43)26(5)34(53-11)19-29(59-46)18-33-25(4)39(54-12)27(6)45(51,60-33)40(47)42(48)49/h22-41,47,50-51H,13-21H2,1-12H3,(H,48,49)/t22-,23+,24+,25+,26+,27-,28+,29+,30-,31+,32+,33-,34+,35-,36+,37-,38-,39?,40-,41+,43?,44-,45-,46+/m0/s1
InChIKey	AINDPXHXPBFFDG-UVRRTGMGSA-N

Species of Metabolite	Component	Source	Comments
Streptomyces (ncbitaxon:1883)	-	PubMed (457584)

ChEBI Ontology

Outgoing Relation(s)
	(2R)-2-hydroxy-2-[(2S,3S,5R,6S)-2-hydroxy-6-[[(4R,5R,6R,7R,9S)-2-[(2R,3R,5S)-5-[(2R,5R)-5-[(2S,3S,5R,6S)-6-hydroxy-3,5,6-trimethyloxan-2-yl]oxolan-2-yl]-3-[(2S,5S,6R)-5-methoxy-6-methyloxan-2-yl]oxyoxolan-2-yl]-7-methoxy-2,4,6-trimethyl-1,10-dioxaspiro[4.5]decan-9-yl]methyl]-4-methoxy-3,5-dimethyloxan-2-yl]acetic acid (CHEBI:223690) is a C-glycosyl compound (CHEBI:20857)

IUPAC Name
(2R)-2-hydroxy-2-[(2S,3S,5R,6S)-2-hydroxy-6-[[(4R,5R,6R,7R,9S)-2-[(2R,3R,5S)-5-[(2R,5R)-5-[(2S,3S,5R,6S)-6-hydroxy-3,5,6-trimethyloxan-2-yl]oxolan-2-yl]-3-[(2S,5S,6R)-5-methoxy-6-methyloxan-2-yl]oxyoxolan-2-yl]-7-methoxy-2,4,6-trimethyl-1,10-dioxaspiro[4.5]decan-9-yl]methyl]-4-methoxy-3,5-dimethyloxan-2-yl]acetic acid

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78443121	ChemSpider