Capsorubin
CAS Registry Number®
470-38-2
CAS Name
CapsorubinMolecular Formula
C40H56O4Molecular Mass
600.87Cite this Page
Capsorubin. CAS Common Chemistry. CAS, a division of the American Chemical Society, n.d. http://commonchemistry.cas.org/detail?cas_rn=470-38-2 (retrieved ) (CAS RN: 470-38-2). Licensed under the Attribution-Noncommercial 4.0 International License (CC BY-NC 4.0).Compound Properties
Melting Point (1)
201 °C
Source(s)
Other Names and Identifiers
InChI
InChI=1S/C40H56O4/c1-29(17-13-19-31(3)21-23-35(43)39(9)27-33(41)25-37(39,5)6)15-11-12-16-30(2)18-14-20-32(4)22-24-36(44)40(10)28-34(42)26-38(40,7)8/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-,39-,40-/m0/s1
InChIKey
InChIKey=GVOIABOMXKDDGU-YUURSNASSA-N
SMILES
C(/C=C/C(=C/C=C/C(=C/C=C/C=C(/C=C/C=C(/C=C/C(=O)[C@]1(C)C[C@@H](O)CC1(C)C)\C)\C)/C)/C)(=O)[C@]2(C)C[C@@H](O)CC2(C)C
Canonical SMILES
O=C(C=CC(=CC=CC(=CC=CC=C(C=CC=C(C=CC(=O)C1(C)CC(O)CC1(C)C)C)C)C)C)C2(C)CC(O)CC2(C)C
Other Names for this Substance
- κ,κ-Carotene-6,6′-dione, 3,3′-dihydroxy-, (3S,3′S,5R,5′R)-
- 2,4,6,8,10,12,14,16,18-Eicosanonaene-1,20-dione, 1,20-bis(4-hydroxy-1,2,2-trimethylcyclopentyl)-4,8,13,17-tetramethyl-, (1R,1R,4S,4S)-(all-E)-
- (3S,3′S,5R,5′R)-3,3′-Dihydroxy-κ,κ-carotene-6,6′-dione
- Capsorubin
- Capsorubin, all-trans-
Deleted or Replaced CAS Registry Numbers
22151-47-9, 28368-02-7