| SpectraBase Spectrum ID |
6UDVo5GeHER |
| Name |
(3S,5R,6R,3'S,5'R,8'S)-3,6 : 5',8' -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/c1-28(17-13-18-30(3)21-22-40-37(7,8)26-33(43-40)27-39(40,10)42)15-11-12-16-29(2)19-14-20-31(4)34-23-35-36(5,6)24-32(41)25-38(35,9)44-34/h11-23,32-34,41-42H,24-27H2,1-10H3/b12-11+,17-13+,19-14+,22-21+,28-15+,29-16+,30-18+,31-20+/t32-,33-,34-,38+,39+,40+/m0/s1 |
| InChIKey |
YMNKXGQZDVGTFM-LRJXZMMBSA-N |
| Molecular Weight |
600.884 g/mol |
| SMILES |
O[C@]1([C@]2(\C=C\C(=C\C=C\C(=C\C=C\C=C\(\C=C\C=C\([C@]3(O[C@@]4(C[C@](CC(C4=C3)(C)C)(O)[H])C)[H])C)C)C)C)O[C@](C1)(CC2(C)C)[H])C |
| SPLASH |
splash10-0ac3-5940001000-d15fab11a5554449a795 |
| Source of Spectrum |
H-79-1443-10 |
| Synonyms |
(2S,6S,7aR)-2-{(1E,3E,5E,7E,9E,11E,13E,15E)-16-[(1R,2R,4S)-2-hydroxy-2,6,6-trimethyl-7-oxabicyclo[2.2.1]hept-1-yl]-1,5,10,14-tetramethyl-1,3,5,7,9,11,13,15-hexadecaoctaenyl}-4,4,7a-trimethyl-2,4,5,6,7,7a-hexahydro-1-benzofuran-6-ol |
| Wiley ID |
1410195 |
