Millisorin B

SpectraBase Compound ID	BwiROqvx1EU
InChI	InChI=1S/C20H26O6/c1-10-6-14(21)7-11(2)9-16(25-19(23)20(5)13(4)26-20)17-12(3)18(22)24-15(17)8-10/h7-8,13-17,21H,3,6,9H2,1-2,4-5H3/b10-8-,11-7-/t13-,14+,15-,16-,17+,20-/m1/s1
InChIKey	KCUQHLKAVMLGGV-LZYLOZORSA-N Google Search
Mol Weight	362.42 g/mol
Molecular Formula	C20H26O6
Exact Mass	362.172939 g/mol

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SpectraBase Spectrum ID	9MNtJksAZ9y
Name	Millisorin B
CAS Registry Number	72229-34-6
Copyright	Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved.
Formula	C20H26O6
InChI	InChI=1S/C20H26O6/c1-10-6-14(21)7-11(2)9-16(25-19(23)20(5)13(4)26-20)17-12(3)18(22)24-15(17)8-10/h7-8,13-17,21H,3,6,9H2,1-2,4-5H3/b10-8-,11-7-/t13-,14+,15-,16-,17+,20-/m1/s1
InChIKey	KCUQHLKAVMLGGV-LZYLOZORSA-N
Molecular Weight	362.422 g/mol
SMILES	O[C@@]1(\C=C/(C[C@]([C@]2(C(C(=O)O[C@@]2(\C=C\(C)C1)[H])=C)[H])(OC([C@@]1(O[C@@]1(C)[H])C)=O)[H])C)[H]
SPLASH	splash10-0bt9-0920000000-17c69d39a947e3c98712
Source of Spectrum	J-45-492-0
Synonyms	Oxiranecarboxylic acid, 2,3-dimethyl-, 2,3,3a,4,5,8,9,11a-octahydro-8-hydroxy-6,10-dimethyl-3-methylene-2-oxocyclodeca(b)furan-4-yl ester, (3aR-(3aR,4R(2R,3R),6E,8S,10E,11aR))- (2R,3R)-2,3-dimethyl-2-oxiranecarboxylic acid [(3aR,4R,6Z,8S,10Z,11aR)-8-hydroxy-6,10-dimethyl-3-methylene-2-oxo-3a,4,5,8,9,11a-hexahydrocyclodeca[b]furan-4-yl] ester [(3aR,4R,6Z,8S,10Z,11aR)-8-hydroxy-6,10-dimethyl-3-methylidene-2-oxo-3a,4,5,8,9,11a-hexahydrocyclodeca[b]furan-4-yl] (2R,3R)-2,3-dimethyloxirane-2-carboxylate [(3aR,4R,6Z,8S,10Z,11aR)-8-hydroxy-6,10-dimethyl-3-methylene-2-oxo-3a,4,5,8,9,11a-hexahydrocyclodeca[b]furan-4-yl] (2R,3R)-2,3-dimethyloxirane-2-carboxylate [(3aR,4R,6Z,8S,10Z,11aR)-6,10-dimethyl-3-methylidene-8-oxidanyl-2-oxidanylidene-3a,4,5,8,9,11a-hexahydrocyclodeca[b]furan-4-yl] (2R,3R)-2,3-dimethyloxirane-2-carboxylate
Wiley ID	1349595