CAS Registry Number®
472-70-8
CAS Name
Cryptoxanthin
Molecular Formula
C40H56O
Molecular Mass
552.87
Compound Properties
-
Melting Point (1)
160 °C
Source(s)
- (1) PhysProp data were obtained from Syracuse Research Corporation of Syracuse, New York (US)
Other Names and Identifiers
InChI
InChI=1S/C40H56O/c1-30(18-13-20-32(3)23-25-37-34(5)22-15-27-39(37,7)8)16-11-12-17-31(2)19-14-21-33(4)24-26-38-35(6)28-36(41)29-40(38,9)10/h11-14,16-21,23-26,36,41H,15,22,27-29H2,1-10H3/b12-11+,18-13+,19-14+,25-23+,26-24+,30-16+,31-17+,32-20+,33-21+/t36-/m1/s1
InChIKey
InChIKey=DMASLKHVQRHNES-FKKUPVFPSA-N
SMILES
C(=C/C(=C/C=C/C(=C/C=C/C=C(/C=C/C=C(/C=C/C=1C(C)(C)CCCC1C)\C)\C)/C)/C)\C=2C(C)(C)C[C@H](O)CC2C
Canonical SMILES
OC1CC(=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)C1)C
Other Names for this Substance
- β,β-Caroten-3-ol, (3R)-
- β-Caroten-3-ol, (R)-all–trans–
- Neo-β-cryptoxanthin
- (3R)-β,β-Caroten-3-ol
- β-Cryptoxanthin, all–trans–
Deleted or Replaced CAS Registry Numbers
1638-03-5, 22004-24-6, 28368-05-0, 34182-32-6
