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(9Z)-Capsanthin-5,6-epoxiode

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(9Z)-Capsanthin-5,6-epoxiode
SpectraBase Compound ID 6cQxJhqPd0K
InChI InChI=1S/C40H56O4/c1-29(17-13-19-31(3)21-22-35(43)38(9)27-33(41)25-36(38,5)6)15-11-12-16-30(2)18-14-20-32(4)23-24-40-37(7,8)26-34(42)28-39(40,10)44-40/h11-24,33-34,41-42H,25-28H2,1-10H3/b12-11+,17-13+,18-14+,22-21+,24-23+,29-15+,30-16+,31-19+,32-20+
InChIKey QAILMWKAKHIIHL-IMJKPWSQSA-N
Mol Weight 600.9 g/mol
Molecular Formula C40H56O4
Exact Mass 600.41786 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID 3mVXfZZiFRK
Name (9Z)-Capsanthin-5,6-epoxiode
Alternate Name(s) (2E,4E,6E,8E,10E,12E,14E,16E,18E)-1-(4-hydroxy-1,2,2-trimethylcyclopentyl)-19-(4-hydroxy-2,2,6-trimethyl-7-oxabicyclo[4.1.0]hept-1-yl)-4,8,13,17-tetramethyl-2,4,6,8,10,12,14,16,18-nonadecanonaen-1-one 5,6-Epoxy-3,3'-dihydroxy-5,6-dihydro-.beta.,.kappa.-caroten-6'-one
Copyright Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved.
Formula C40H56O4
InChI InChI=1S/C40H56O4/c1-29(17-13-19-31(3)21-22-35(43)38(9)27-33(41)25-36(38,5)6)15-11-12-16-30(2)18-14-20-32(4)23-24-40-37(7,8)26-34(42)28-39(40,10)44-40/h11-24,33-34,41-42H,25-28H2,1-10H3/b12-11+,17-13+,18-14+,22-21+,24-23+,29-15+,30-16+,31-19+,32-20+
InChIKey QAILMWKAKHIIHL-IMJKPWSQSA-N
Molecular Weight 600.884 g/mol
SMILES OC1CC2(C(\C=C\C(=C\C=C\C(=C\C=C\C=C\(\C=C\C=C\(\C=C\C(C3(CC(CC3(C)C)O)C)=O)C)C)C)C)(C(C1)(C)C)O2)C
SPLASH splash10-0k96-7910205000-3fc9f6687627f3e00c09
Source of Spectrum G4-64-1255-1
Wiley ID 1609194