β,β-Caroten-4-ol
CAS Registry Number®
472-62-8
CAS Name
β,β-Caroten-4-olMolecular Formula
C40H56OMolecular Mass
552.87Cite this Page
β,β-Caroten-4-ol. CAS Common Chemistry. CAS, a division of the American Chemical Society, n.d. http://commonchemistry.cas.org/detail?cas_rn=472-62-8 (retrieved ) (CAS RN: 472-62-8). Licensed under the Attribution-Noncommercial 4.0 International License (CC BY-NC 4.0).Other Names and Identifiers
InChI
InChI=1S/C40H56O/c1-30(18-13-20-32(3)23-25-36-34(5)22-15-28-39(36,7)8)16-11-12-17-31(2)19-14-21-33(4)24-26-37-35(6)38(41)27-29-40(37,9)10/h11-14,16-21,23-26,38,41H,15,22,27-29H2,1-10H3
InChIKey
InChIKey=JCRCKXUPYKELBT-UHFFFAOYSA-N
SMILES
C(=CC(=CC=CC(=CC=CC=C(C=CC=C(C=CC=1C(C)(C)CCCC1C)C)C)C)C)C=2C(C)(C)CCC(O)C2C
Canonical SMILES
OC1C(=C(C=CC(=CC=CC(=CC=CC=C(C=CC=C(C=CC2=C(C)CCCC2(C)C)C)C)C)C)C(C)(C)CC1)C
Other Names for this Substance
- β,β-Caroten-4-ol
- Isocryptoxanthin
- β-Caroten-4-ol, all-trans-
- Isocryptoxanthin, all-trans-