SpectraBase Spectrum ID |
BQjaXBTyTzw |
Name |
.kappa.,.chi.-Caroten-6-one, 8-hydroxy-, (5R)- |
CAS Registry Number |
122673-54-5 |
Copyright |
Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved. |
Formula |
C40H52O2 |
InChI |
InChI=1S/C40H52O2/c1-29(18-13-19-31(3)22-24-36-25-23-32(4)34(6)35(36)7)16-11-12-17-30(2)20-14-21-33(5)37(41)28-38(42)40(10)27-15-26-39(40,8)9/h11-14,16-25,28,41H,15,26-27H2,1-10H3/b12-11+,18-13+,20-14+,24-22+,29-16+,30-17+,31-19+,33-21+,37-28-/t40-/m0/s1 |
InChIKey |
ZHOHENIQZPTRIZ-WCOKXOMASA-N |
Molecular Weight |
564.854 g/mol |
SMILES |
O\C(=C/C([C@]1(C(CCC1)(C)C)C)=O)\C(=C\C=C\C(=C\C=C\C=C\(\C=C\C=C\(\C=C\c1c(c(C)c(cc1)C)C)C)C)C)C |
SPLASH |
splash10-0btc-4900110000-51d9c4b1c2ebd3a74ee8 |
Source of Spectrum |
KC-1988-1381-66 |
Synonyms |
(5R)-8-hydroxy-.kappa.,.chi.-caroten-6-one
(5R)-8-hydroxy-kappa,chi-caroten-6-one |
Wiley ID |
1407209 |