Torularhodin
CAS Registry Number®
514-92-1
CAS Name
TorularhodinMolecular Formula
C40H52O2Molecular Mass
564.84Cite this Page
Torularhodin. CAS Common Chemistry. CAS, a division of the American Chemical Society, n.d. http://commonchemistry.cas.org/detail?cas_rn=514-92-1 (retrieved ) (CAS RN: 514-92-1). Licensed under the Attribution-Noncommercial 4.0 International License (CC BY-NC 4.0).Compound Properties
Melting Point (1)
211 °C
Source(s)
- (1) PhysProp data were obtained from Syracuse Research Corporation of Syracuse, New York (US)
Other Names and Identifiers
InChI
InChI=1S/C40H52O2/c1-31(19-12-21-33(3)22-13-23-34(4)25-15-26-37(7)39(41)42)17-10-11-18-32(2)20-14-24-35(5)28-29-38-36(6)27-16-30-40(38,8)9/h10-15,17-26,28-29H,16,27,30H2,1-9H3,(H,41,42)/b11-10+,19-12+,20-14+,22-13+,25-15+,29-28+,31-17+,32-18+,33-21+,34-23+,35-24+,37-26+
InChIKey
InChIKey=NESPPCWGYRQEJQ-VATUXEBJSA-N
SMILES
C(=C/C(=C/C=C/C(=C/C=C/C=C(/C=C/C=C(/C=C/C=C(/C=C/C=C(/C(O)=O)\C)\C)\C)\C)/C)/C)\C=1C(C)(C)CCCC1C
Canonical SMILES
O=C(O)C(=CC=CC(=CC=CC(=CC=CC(=CC=CC=C(C=CC=C(C=CC1=C(C)CCCC1(C)C)C)C)C)C)C)C
Other Names for this Substance
- β,ψ-Caroten-16′-oic acid, 3′,4′-didehydro-
- γ-Caroten-16′-oic acid, 3′,4′-didehydro-, all-trans-
- γ-Caroten-16′-oic acid, 3′,4′-didehydro-
- 3′,4′-Didehydro-β,ψ-caroten-16′-oic acid
- Torularhodin, all-trans-
Deleted or Replaced CAS Registry Numbers
17334-35-9