Echinenone

CAS Registry Number®

432-68-8

CAS Name

Echinenone

Molecular Formula

C40H54O

Molecular Mass

550.86

Cite this Page

Echinenone.   CAS Common Chemistry.   CAS, a division of the American Chemical Society, n.d.   http://commonchemistry.cas.org/detail?cas_rn=432-68-8 (retrieved 2024-12-19) (CAS RN: 432-68-8).  Licensed under the Attribution-Noncommercial 4.0 International License (CC BY-NC 4.0).

Compound Properties

  • Melting Point (1)

    179 °C

Source(s)

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

Other Names and Identifiers

InChI

InChI=1S/C40H54O/c1-30(18-13-20-32(3)23-25-36-34(5)22-15-28-39(36,7)8)16-11-12-17-31(2)19-14-21-33(4)24-26-37-35(6)38(41)27-29-40(37,9)10/h11-14,16-21,23-26H,15,22,27-29H2,1-10H3/b12-11+,18-13+,19-14+,25-23+,26-24+,30-16+,31-17+,32-20+,33-21+

InChIKey

InChIKey=QXNWZXMBUKUYMD-QQGJMDNJSA-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)CCC(=O)C2C

Canonical SMILES

O=C1C(=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)CC1)C

Other Names for this Substance

  • β,β-Caroten-4-one
  • β-Caroten-4-one, all-trans-
  • β-Caroten-4-one
  • Echinenone
  • Echinenon

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Deleted or Replaced CAS Registry Numbers

7540-35-4

CAS INSIGHTSTM
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