| SpectraBase Spectrum ID |
DJC80DGGtoR |
| Name |
(3S,5R,6R,3'S,5'R,6'S)-3,6 : 5',6'-diepoxy-5,6,5',6'-tetrahydro-.beta.,.beta.-carotene-5,3'-diol |
| Copyright |
Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved. |
| Formula |
C40H56O4 |
| InChI |
InChI=1S/C40H56O4/c1-29(17-13-19-31(3)21-23-39-36(7,8)27-34(43-39)28-37(39,9)42)15-11-12-16-30(2)18-14-20-32(4)22-24-40-35(5,6)25-33(41)26-38(40,10)44-40/h11-24,33-34,41-42H,25-28H2,1-10H3/b12-11+,17-13+,18-14+,23-21+,24-22+,29-15+,30-16+,31-19+,32-20+/t33-,34-,37+,38+,39+,40-/m0/s1 |
| InChIKey |
WBXYNQBROQPCES-UVAHLJQVSA-N |
| Molecular Weight |
600.884 g/mol |
| SMILES |
O[C@@]1(C[C@@]2([C@](\C=C\C(=C\C=C\C(=C\C=C\C=C\(\C=C\C=C\(\C=C\[C@@]34[C@@](C[C@](CC4(C)C)(O3)[H])(O)C)C)C)C)C)(C(C1)(C)C)O2)C)[H] |
| SPLASH |
splash10-0uk9-0360049000-9b09fac19b76ebc76cbd |
| Source of Spectrum |
H-76-956-2 |
| Synonyms |
(3S,5R,6R,3'S,5'R,6'S)-3,6 : 5',6'-diepoxy-5,6,5',6'-tetrahydro-.beta.,.beta.-carotene-5,3'-diol-(5',6'-diepi derivative)
(1R,2R,4S)-1-{(1E,3E,5E,7E,9E,11E,13E,15E,17E)-18-[(1S,4S,6R)-4-hydroxy-2,2,6-trimethyl-7-oxabicyclo[4.1.0]hept-1-yl]-3,7,12,16-tetramethyl-1,3,5,7,9,11,13,15,17-octadecanonaenyl}-2,6,6-trimethyl-7-oxabicyclo[2.2.1]heptan-2-ol |
| Wiley ID |
1410193 |
