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3'-O-ACETYL-3'-EPIFROSIDE
SpectraBase Compound ID IX2Y7qn0C88
InChI InChI=1S/C31H44O10/c1-15-9-25(39-16(2)32)31(36)27(38-15)40-22-11-18-5-6-20-19(28(18,3)13-23(22)41-31)7-8-29(4)21(12-24(33)30(20,29)35)17-10-26(34)37-14-17/h10,15,18-25,27,33,35-36H,5-9,11-14H2,1-4H3
InChIKey OOUOIIZPZLERFO-UHFFFAOYSA-N
Mol Weight 576.7 g/mol
Molecular Formula C31H44O10
Exact Mass 576.293448 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID IK25G74aZTa
Name Card-20(22)-enolide, 2,3-[[4-(acetyloxy)tetrahydro-3-hydroxy-6-methyl-2H-pyran-3,2-diyl]bi s(oxy)]-14,15-dihydroxy-, [2.alpha.(2S,3S,4S,6R),3.beta.,5.alpha.,15.beta.]-
CAS Registry Number 88972-31-0
Copyright Copyright © 2020-2025 John Wiley & Sons, Inc. All Rights Reserved.
Formula C31H44O10
InChI InChI=1S/C31H44O10/c1-15-9-25(39-16(2)32)31(36)27(38-15)40-22-11-18-5-6-20-19(28(18,3)13-23(22)41-31)7-8-29(4)21(12-24(33)30(20,29)35)17-10-26(34)37-14-17/h10,15,18-25,27,33,35-36H,5-9,11-14H2,1-4H3
InChIKey OOUOIIZPZLERFO-UHFFFAOYSA-N
Molecular Weight 576.683 g/mol
SMILES OC1CC(C2(CCC3C(C12O)CCC1CC2OC4C(OC2CC31C)(C(CC(O4)C)OC(=O)C)O)C)C1=CC(=O)OC1
SPLASH splash10-004i-0900000000-2b9bb059486bf3803806
Source of Spectrum KC-1983-2834-0
Synonyms 1H,9H-Cyclopenta[7,8]phenanthro[2,3-b]pyrano[3,2-e][1,4]dioxin, card-20(22)-enolide deriv. 3'-Epiafroside 3'-acetate 3,3a,11a-trihydroxy-9,13a,15a-trimethyl-1-(5-oxo-2,5-dihydro-3-furanyl)icosahydro-1H,7aH-cyclopenta[7,8]phenanthro[2,3-b]pyrano[3,2-e][1,4]dioxin-11-yl acetate
Wiley ID 1408208