(3R,6′S)-3′,18′-Didehydro-β,ε-carotene-3,6′-diol

CAS Registry Number®

158312-69-7

CAS Name

(3R,6′S)-3′,18′-Didehydro-β,ε-carotene-3,6′-diol

Molecular Formula

C40H54O2

Molecular Mass

566.86

Cite this Page

(3R,6′S)-3′,18′-Didehydro-β,ε-carotene-3,6′-diol.   CAS Common Chemistry.   CAS, a division of the American Chemical Society, n.d.   http://commonchemistry.cas.org/detail?cas_rn=158312-69-7 (retrieved 2024-11-22) (CAS RN: 158312-69-7).  Licensed under the Attribution-Noncommercial 4.0 International License (CC BY-NC 4.0).

Other Names and Identifiers

InChI

InChI=1S/C40H54O2/c1-30(18-13-20-32(3)23-24-37-34(5)28-36(41)29-38(37,7)8)16-11-12-17-31(2)19-14-21-33(4)25-27-40(42)35(6)22-15-26-39(40,9)10/h11-25,27,36,41-42H,6,26,28-29H2,1-5,7-10H3/b12-11+,18-13+,19-14+,24-23+,27-25+,30-16+,31-17+,32-20+,33-21+/t36-,40-/m1/s1

InChIKey

InChIKey=BYJIOUBZISYXSQ-ULZYCWJBSA-N

SMILES

C(=C/C(=C/C=C/C(=C/C=C/C=C(/C=C/C=C(/C=C/C=1C(C)(C)C[C@H](O)CC1C)\C)\C)/C)/C)\[C@]2(O)C(C)(C)CC=CC2=C

Canonical SMILES

OC1CC(=C(C=CC(=CC=CC(=CC=CC=C(C=CC=C(C=CC2(O)C(=C)C=CCC2(C)C)C)C)C)C)C(C)(C)C1)C

Other Names for this Substance

  • β,ε-Carotene-3,6′-diol, 3′,18′-didehydro-, (3R,6′S)-
  • (3R,6′S)-3′,18′-Didehydro-β,ε-carotene-3,6′-diol
  • Nigroxanthin

CAS INSIGHTSTM
Targeted protein degrader structure, illustration