Cryptoxanthin

CAS Registry Number®

472-70-8
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CAS Name

Cryptoxanthin

Molecular Formula

C40H56O

Molecular Mass

552.87

Cite this Page

Cryptoxanthin.   CAS Common Chemistry.   CAS, a division of the American Chemical Society, n.d.   http://commonchemistry.cas.org/ChemicalDetail.aspx?ref=472-70-8 (retrieved 2024-03-19) (CAS RN: 472-70-8).  Licensed under the Attribution-Noncommercial 4.0 International License (CC BY-NC 4.0).

Compound Properties

  • Melting Point (1)

    160 °C

Source(s)

  • (1) PhysProp data were obtained from Syracuse Research Corporation of Syracuse, New York (US)

Other Names and Identifiers

InChI

InChI=1S/C40H56O/c1-30(18-13-20-32(3)23-25-37-34(5)22-15-27-39(37,7)8)16-11-12-17-31(2)19-14-21-33(4)24-26-38-35(6)28-36(41)29-40(38,9)10/h11-14,16-21,23-26,36,41H,15,22,27-29H2,1-10H3/b12-11+,18-13+,19-14+,25-23+,26-24+,30-16+,31-17+,32-20+,33-21+/t36-/m1/s1

InChIKey

InChIKey=DMASLKHVQRHNES-FKKUPVFPSA-N

SMILES

C(=C/C(=C/C=C/C(=C/C=C/C=C(/C=C/C=C(/C=C/C=1C(C)(C)CCCC1C)\C)\C)/C)/C)\C=2C(C)(C)C[C@H](O)CC2C

Canonical SMILES

OC1CC(=C(C=CC(=CC=CC(=CC=CC=C(C=CC=C(C=CC2=C(C)CCCC2(C)C)C)C)C)C)C(C)(C)C1)C

Other Names for this Substance

  • β,β-Caroten-3-ol, (3R)-
  • β-Caroten-3-ol, (R)-all-trans-
  • Neo-β-cryptoxanthin
  • (3R)-β,β-Caroten-3-ol
  • β-Cryptoxanthin, all-trans-

Deleted or Replaced CAS Registry Numbers

1638-03-5, 22004-24-6, 28368-05-0, 34182-32-6

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