7′,8′-Didehydro-5,6-epoxy-6,7-dihydro-3,3′-dihydroxy-β,β-caroten-8(5H)-one

CAS Registry Number®

81306-52-7
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CAS Name

7′,8′-Didehydro-5,6-epoxy-6,7-dihydro-3,3′-dihydroxy-β,β-caroten-8(5H)-one

Molecular Formula

C40H54O4

Molecular Mass

598.85

Cite this Page

7′,8′-Didehydro-5,6-epoxy-6,7-dihydro-3,3′-dihydroxy-β,β-caroten-8(5H)-one.   CAS Common Chemistry.   CAS, a division of the American Chemical Society, n.d.   http://commonchemistry.cas.org/detail?cas_rn=81306-52-7 (retrieved 2024-09-19) (CAS RN: 81306-52-7).  Licensed under the Attribution-Noncommercial 4.0 International License (CC BY-NC 4.0).

Other Names and Identifiers

InChI

InChI=1S/C40H54O4/c1-28(17-13-18-30(3)21-22-35-32(5)23-33(41)24-37(35,6)7)15-11-12-16-29(2)19-14-20-31(4)36(43)27-40-38(8,9)25-34(42)26-39(40,10)44-40/h11-20,33-34,41-42H,23-27H2,1-10H3

InChIKey

InChIKey=CNOIXMULOQWVGR-UHFFFAOYSA-N

SMILES

C(C(C(=CC=CC(=CC=CC=C(C=CC=C(C#CC=1C(C)(C)CC(O)CC1C)C)C)C)C)=O)C23C(C)(O2)CC(O)CC3(C)C

Canonical SMILES

O=C(C(=CC=CC(=CC=CC=C(C=CC=C(C#CC1=C(C)CC(O)CC1(C)C)C)C)C)C)CC23OC3(C)CC(O)CC2(C)C

Other Names for this Substance

  • β,β-Caroten-8(5H)-one, 7′,8′-didehydro-5,6-epoxy-6,7-dihydro-3,3′-dihydroxy-
  • β,β-Carotene-3,3′-diol, 7′,8′-didehydro-5,6-epoxy-5,6,7,8-tetrahydro-8-oxo-, (3S,3′R,5R,6S)-
  • 7′,8′-Didehydro-5,6-epoxy-6,7-dihydro-3,3′-dihydroxy-β,β-caroten-8(5H)-one
  • Halocynthiaxanthin