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Proceroside
SpectraBase Compound ID 8bNPsb4HJqJ
InChI InChI=1S/C29H40O10/c1-26-6-4-19-20(28(26,34)7-5-18(26)15-8-24(33)36-13-15)3-2-16-9-21-22(11-27(16,19)14-31)39-29(35)23(32)10-17(12-30)37-25(29)38-21/h8,14,16-23,25,30,32,34-35H,2-7,9-13H2,1H3
InChIKey NXCIXUFRIWJEEC-UHFFFAOYSA-N
Mol Weight 548.6 g/mol
Molecular Formula C29H40O10
Exact Mass 548.262147 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID IbvAfNuqXZB
Name Proceroside
Alternate Name(s) 3a,11,11a-trihydroxy-9-(hydroxymethyl)-15a-methyl-1-(5-oxo-2,5-dihydro-3-furanyl)icosahydro-7aH,13aH-cyclopenta[7,8]phenanthro[2,3-b]pyrano[3,2-e][1,4]dioxin-13a-carbaldehyde
CAS Registry Number 25323-74-4
Copyright Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved.
Formula C29H40O10
InChI InChI=1S/C29H40O10/c1-26-6-4-19-20(28(26,34)7-5-18(26)15-8-24(33)36-13-15)3-2-16-9-21-22(11-27(16,19)14-31)39-29(35)23(32)10-17(12-30)37-25(29)38-21/h8,14,16-23,25,30,32,34-35H,2-7,9-13H2,1H3
InChIKey NXCIXUFRIWJEEC-UHFFFAOYSA-N
Molecular Weight 548.629 g/mol
SMILES OC12C3C(C4(CC5C(OC6C(O5)(C(CC(O6)CO)O)O)CC4CC3)C=O)CCC1(C(CC2)C1=CC(=O)OC1)C
SPLASH splash10-03fr-9800000000-a899045ba933e0a585a0
Source of Spectrum H-52-2097-4
Wiley ID 1405443