(E)-4-[(2S,3S,4S,5R)-3,4-bis(oxidanyl)-5-[[3-[(2S)-3-oxidanylbutan-2-yl]oxiran-2-yl]methyl]oxan-2-yl]-3-methyl-but-2-enoic acid

SpectraBase Compound ID	4xsrWR8chnO
InChI	InChI=1S/C17H28O7/c1-8(5-14(19)20)4-12-16(22)15(21)11(7-23-12)6-13-17(24-13)9(2)10(3)18/h5,9-13,15-18,21-22H,4,6-7H2,1-3H3,(H,19,20)/b8-5+/t9-,10?,11+,12-,13?,15-,16+,17?/m0/s1
InChIKey	IUBMRJVNZLQSHU-VPUSNWGPSA-N Google Search
Mol Weight	344.4 g/mol
Molecular Formula	C17H28O7
Exact Mass	344.183503 g/mol

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SpectraBase Spectrum ID	BVR3g234CeK
Name	(E)-4-[(2S,3S,4S,5R)-3,4-bis(oxidanyl)-5-[[3-[(2S)-3-oxidanylbutan-2-yl]oxiran-2-yl]methyl]oxan-2-yl]-3-methyl-but-2-enoic acid
CAS Registry Number	66262-68-8
Copyright	Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved.
Formula	C17H28O7
InChI	InChI=1S/C17H28O7/c1-8(5-14(19)20)4-12-16(22)15(21)11(7-23-12)6-13-17(24-13)9(2)10(3)18/h5,9-13,15-18,21-22H,4,6-7H2,1-3H3,(H,19,20)/b8-5+/t9-,10?,11+,12-,13?,15-,16+,17?/m0/s1
InChIKey	IUBMRJVNZLQSHU-VPUSNWGPSA-N
Molecular Weight	344.404 g/mol
SMILES	OC([C@@](C1OC1C[C@@]1(CO[C@]([C@]([C@]1(O)[H])(O)[H])(C\C(=C\C(=O)O)C)[H])[H])(C)[H])C
SPLASH	splash10-03fr-0950000000-faa7ad3a781b9a2315ff
Source of Spectrum	KC-1979-312-0
Synonyms	(E)-4-[(2S,3S,4S,5R)-3,4-dihydroxy-5-[[3-[(1S)-2-hydroxy-1-methyl-propyl]oxiran-2-yl]methyl]tetrahydropyran-2-yl]-3-methyl-but-2-enoic acid (E)-4-[(2S,3S,4S,5R)-3,4-dihydroxy-5-[[3-[(2S)-3-hydroxybutan-2-yl]-2-oxiranyl]methyl]-2-oxanyl]-3-methyl-2-butenoic acid (E)-4-[(2S,3S,4S,5R)-3,4-dihydroxy-5-[[3-[(2S)-3-hydroxybutan-2-yl]oxiran-2-yl]methyl]oxan-2-yl]-3-methylbut-2-enoic acid Monic acid Monic acid A
Wiley ID	1337767