Exposome-Explorer: show components

alpha-Cryptoxanthin

ID	1409
Name	alpha-Cryptoxanthin
Synonyms	all-trans-alpha-Cryptoxanthin
Structure	MOL SDF 3D-SDF PDB SMILES InChI View 3D Structure Structure for EE001409 (alpha-Cryptoxanthin) 3D Structure for EE001409 (alpha-Cryptoxanthin) 23724629 -OEChem-10131806513D 97 98 0 1 0 0 0 0 0999 V2000 14.7545 -0.9876 0.5329 O 0 0 0 0 0 0 0 0 0 0 0 0 11.5936 0.1848 -1.1673 C 0 0 0 0 0 0 0 0 0 0 0 0 10.7136 -0.1395 0.0929 C 0 0 2 0 0 0 0 0 0 0 0 0 13.0786 0.1781 -0.7385 C 0 0 0 0 0 0 0 0 0 0 0 0 13.5171 -1.1664 -0.1532 C 0 0 2 0 0 0 0 0 0 0 0 0 11.2581 -1.2860 0.9441 C 0 0 0 0 0 0 0 0 0 0 0 0 11.3806 -0.8284 -2.3167 C 0 0 0 0 0 0 0 0 0 0 0 0 11.2550 1.5909 -1.7086 C 0 0 0 0 0 0 0 0 0 0 0 0 -11.7247 1.3942 -0.1075 C 0 0 0 0 0 0 0 0 0 0 0 0 12.5192 -1.7366 0.8074 C 0 0 0 0 0 0 0 0 0 0 0 0 9.2653 -0.3323 -0.2721 C 0 0 0 0 0 0 0 0 0 0 0 0 -13.2539 1.6358 0.0178 C 0 0 0 0 0 0 0 0 0 0 0 0 -14.0628 0.6130 -0.7593 C 0 0 0 0 0 0 0 0 0 0 0 0 -11.3699 -0.1026 0.0557 C 0 0 0 0 0 0 0 0 0 0 0 0 10.3650 -1.8623 2.0119 C 0 0 0 0 0 0 0 0 0 0 0 0 -13.7776 -0.7857 -0.2335 C 0 0 0 0 0 0 0 0 0 0 0 0 -12.3127 -1.0777 0.0229 C 0 0 0 0 0 0 0 0 0 0 0 0 -11.2491 1.8907 -1.4922 C 0 0 0 0 0 0 0 0 0 0 0 0 -11.0636 2.2718 0.9835 C 0 0 0 0 0 0 0 0 0 0 0 0 8.2784 0.4675 0.1634 C 0 0 0 0 0 0 0 0 0 0 0 0 -9.9564 -0.3985 0.2218 C 0 0 0 0 0 0 0 0 0 0 0 0 -12.0637 -2.5545 0.2265 C 0 0 0 0 0 0 0 0 0 0 0 0 6.8498 0.3497 -0.1438 C 0 0 0 0 0 0 0 0 0 0 0 0 -9.3472 -1.4351 -0.3725 C 0 0 0 0 0 0 0 0 0 0 0 0 6.4285 -0.7905 -1.0376 C 0 0 0 0 0 0 0 0 0 0 0 0 6.0042 1.2564 0.3921 C 0 0 0 0 0 0 0 0 0 0 0 0 -7.9412 -1.7713 -0.2080 C 0 0 0 0 0 0 0 0 0 0 0 0 -7.6760 -3.2517 -0.1305 C 0 0 0 0 0 0 0 0 0 0 0 0 4.5676 1.3336 0.2200 C 0 0 0 0 0 0 0 0 0 0 0 0 -6.9249 -0.8880 -0.1513 C 0 0 0 0 0 0 0 0 0 0 0 0 3.8131 2.2814 0.8008 C 0 0 0 0 0 0 0 0 0 0 0 0 -5.5099 -1.1523 0.0102 C 0 0 0 0 0 0 0 0 0 0 0 0 2.3707 2.3984 0.6372 C 0 0 0 0 0 0 0 0 0 0 0 0 -4.4988 -0.2687 0.0664 C 0 0 0 0 0 0 0 0 0 0 0 0 1.8882 3.8208 0.5279 C 0 0 0 0 0 0 0 0 0 0 0 0 -3.0704 -0.5284 0.2289 C 0 0 0 0 0 0 0 0 0 0 0 0 1.4989 1.3702 0.6026 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.1755 0.4792 0.2662 C 0 0 0 0 0 0 0 0 0 0 0 0 0.0605 1.4517 0.4414 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.7435 -1.9968 0.3001 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.7387 0.3731 0.4177 C 0 0 0 0 0 0 0 0 0 0 0 0 10.7795 0.7388 0.7548 H 0 0 0 0 0 0 0 0 0 0 0 0 13.2557 0.9726 0.0011 H 0 0 0 0 0 0 0 0 0 0 0 0 13.7317 0.4286 -1.5853 H 0 0 0 0 0 0 0 0 0 0 0 0 13.6907 -1.8966 -0.9516 H 0 0 0 0 0 0 0 0 0 0 0 0 12.1223 -0.6771 -3.1097 H 0 0 0 0 0 0 0 0 0 0 0 0 10.3948 -0.7138 -2.7809 H 0 0 0 0 0 0 0 0 0 0 0 0 11.4666 -1.8657 -1.9780 H 0 0 0 0 0 0 0 0 0 0 0 0 11.9067 1.8551 -2.5495 H 0 0 0 0 0 0 0 0 0 0 0 0 11.3871 2.3558 -0.9352 H 0 0 0 0 0 0 0 0 0 0 0 0 10.2212 1.6509 -2.0651 H 0 0 0 0 0 0 0 0 0 0 0 0 12.8640 -2.5586 1.4307 H 0 0 0 0 0 0 0 0 0 0 0 0 -13.5127 2.6442 -0.3294 H 0 0 0 0 0 0 0 0 0 0 0 0 -13.5557 1.5888 1.0737 H 0 0 0 0 0 0 0 0 0 0 0 0 9.0343 -1.1870 -0.9021 H 0 0 0 0 0 0 0 0 0 0 0 0 -15.1331 0.8295 -0.6632 H 0 0 0 0 0 0 0 0 0 0 0 0 -13.8284 0.6686 -1.8285 H 0 0 0 0 0 0 0 0 0 0 0 0 -14.3262 -0.9361 0.7054 H 0 0 0 0 0 0 0 0 0 0 0 0 -14.1778 -1.5085 -0.9555 H 0 0 0 0 0 0 0 0 0 0 0 0 10.8987 -2.5651 2.6610 H 0 0 0 0 0 0 0 0 0 0 0 0 9.9731 -1.0642 2.6511 H 0 0 0 0 0 0 0 0 0 0 0 0 9.5246 -2.4040 1.5665 H 0 0 0 0 0 0 0 0 0 0 0 0 -10.1567 1.8532 -1.5779 H 0 0 0 0 0 0 0 0 0 0 0 0 -11.6591 1.2835 -2.3065 H 0 0 0 0 0 0 0 0 0 0 0 0 -11.5512 2.9300 -1.6650 H 0 0 0 0 0 0 0 0 0 0 0 0 -11.2606 1.8766 1.9869 H 0 0 0 0 0 0 0 0 0 0 0 0 -9.9786 2.3490 0.8542 H 0 0 0 0 0 0 0 0 0 0 0 0 -11.4527 3.2967 0.9490 H 0 0 0 0 0 0 0 0 0 0 0 0 15.3973 -0.6406 -0.1092 H 0 0 0 0 0 0 0 0 0 0 0 0 8.5552 1.3026 0.8061 H 0 0 0 0 0 0 0 0 0 0 0 0 -9.3942 0.2301 0.9047 H 0 0 0 0 0 0 0 0 0 0 0 0 -11.1887 -2.7691 0.8451 H 0 0 0 0 0 0 0 0 0 0 0 0 -12.9070 -3.0041 0.7649 H 0 0 0 0 0 0 0 0 0 0 0 0 -11.9767 -3.0680 -0.7360 H 0 0 0 0 0 0 0 0 0 0 0 0 -9.8757 -2.0718 -1.0772 H 0 0 0 0 0 0 0 0 0 0 0 0 6.7007 -1.7515 -0.5867 H 0 0 0 0 0 0 0 0 0 0 0 0 6.9161 -0.7104 -2.0159 H 0 0 0 0 0 0 0 0 0 0 0 0 5.3543 -0.8306 -1.2278 H 0 0 0 0 0 0 0 0 0 0 0 0 6.4185 2.0378 1.0304 H 0 0 0 0 0 0 0 0 0 0 0 0 -6.9407 -3.5008 0.6415 H 0 0 0 0 0 0 0 0 0 0 0 0 -8.5822 -3.8102 0.1337 H 0 0 0 0 0 0 0 0 0 0 0 0 -7.3250 -3.6289 -1.0968 H 0 0 0 0 0 0 0 0 0 0 0 0 4.0893 0.5973 -0.4165 H 0 0 0 0 0 0 0 0 0 0 0 0 -7.1641 0.1724 -0.2343 H 0 0 0 0 0 0 0 0 0 0 0 0 4.2793 3.0391 1.4275 H 0 0 0 0 0 0 0 0 0 0 0 0 -5.2656 -2.2079 0.0827 H 0 0 0 0 0 0 0 0 0 0 0 0 -4.7631 0.7865 -0.0127 H 0 0 0 0 0 0 0 0 0 0 0 0 2.6929 4.4943 0.2089 H 0 0 0 0 0 0 0 0 0 0 0 0 1.0961 3.9377 -0.2184 H 0 0 0 0 0 0 0 0 0 0 0 0 1.5235 4.1763 1.4975 H 0 0 0 0 0 0 0 0 0 0 0 0 1.8908 0.3587 0.7057 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.5506 1.4998 0.1848 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.3853 2.4378 0.3511 H 0 0 0 0 0 0 0 0 0 0 0 0 -3.0647 -2.5176 -0.6093 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.6733 -2.1945 0.3979 H 0 0 0 0 0 0 0 0 0 0 0 0 -3.2188 -2.4631 1.1707 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.2992 -0.6136 0.5163 H 0 0 0 0 0 0 0 0 0 0 0 0 1 5 1 0 0 0 0 1 69 1 0 0 0 0 2 3 1 0 0 0 0 2 4 1 0 0 0 0 2 7 1 0 0 0 0 2 8 1 0 0 0 0 3 6 1 0 0 0 0 3 11 1 0 0 0 0 3 42 1 0 0 0 0 4 5 1 0 0 0 0 4 43 1 0 0 0 0 4 44 1 0 0 0 0 5 10 1 0 0 0 0 5 45 1 0 0 0 0 6 10 2 0 0 0 0 6 15 1 0 0 0 0 7 46 1 0 0 0 0 7 47 1 0 0 0 0 7 48 1 0 0 0 0 8 49 1 0 0 0 0 8 50 1 0 0 0 0 8 51 1 0 0 0 0 9 12 1 0 0 0 0 9 14 1 0 0 0 0 9 18 1 0 0 0 0 9 19 1 0 0 0 0 10 52 1 0 0 0 0 11 20 2 0 0 0 0 11 55 1 0 0 0 0 12 13 1 0 0 0 0 12 53 1 0 0 0 0 12 54 1 0 0 0 0 13 16 1 0 0 0 0 13 56 1 0 0 0 0 13 57 1 0 0 0 0 14 17 2 0 0 0 0 14 21 1 0 0 0 0 15 60 1 0 0 0 0 15 61 1 0 0 0 0 15 62 1 0 0 0 0 16 17 1 0 0 0 0 16 58 1 0 0 0 0 16 59 1 0 0 0 0 17 22 1 0 0 0 0 18 63 1 0 0 0 0 18 64 1 0 0 0 0 18 65 1 0 0 0 0 19 66 1 0 0 0 0 19 67 1 0 0 0 0 19 68 1 0 0 0 0 20 23 1 0 0 0 0 20 70 1 0 0 0 0 21 24 2 0 0 0 0 21 71 1 0 0 0 0 22 72 1 0 0 0 0 22 73 1 0 0 0 0 22 74 1 0 0 0 0 23 25 1 0 0 0 0 23 26 2 0 0 0 0 24 27 1 0 0 0 0 24 75 1 0 0 0 0 25 76 1 0 0 0 0 25 77 1 0 0 0 0 25 78 1 0 0 0 0 26 29 1 0 0 0 0 26 79 1 0 0 0 0 27 28 1 0 0 0 0 27 30 2 0 0 0 0 28 80 1 0 0 0 0 28 81 1 0 0 0 0 28 82 1 0 0 0 0 29 31 2 0 0 0 0 29 83 1 0 0 0 0 30 32 1 0 0 0 0 30 84 1 0 0 0 0 31 33 1 0 0 0 0 31 85 1 0 0 0 0 32 34 2 0 0 0 0 32 86 1 0 0 0 0 33 35 1 0 0 0 0 33 37 2 0 0 0 0 34 36 1 0 0 0 0 34 87 1 0 0 0 0 35 88 1 0 0 0 0 35 89 1 0 0 0 0 35 90 1 0 0 0 0 36 38 2 0 0 0 0 36 40 1 0 0 0 0 37 39 1 0 0 0 0 37 91 1 0 0 0 0 38 41 1 0 0 0 0 38 92 1 0 0 0 0 39 41 2 0 0 0 0 39 93 1 0 0 0 0 40 94 1 0 0 0 0 40 95 1 0 0 0 0 40 96 1 0 0 0 0 41 97 1 0 0 0 0 M END > <PUBCHEM_COMPOUND_CID> 23724629 > <PUBCHEM_CONFORMER_RMSD> 1.2 > <PUBCHEM_CONFORMER_DIVERSEORDER> 27 87 1 55 230 152 208 94 49 89 82 267 19 183 240 108 22 156 83 178 7 150 214 146 5 28 234 30 114 35 96 93 45 123 200 85 161 76 231 130 79 34 192 64 246 68 186 32 51 216 148 222 62 11 139 247 67 58 168 69 80 36 136 71 115 177 20 207 60 3 235 81 75 24 174 37 195 40 160 155 144 249 185 15 12 135 143 278 77 18 227 91 112 244 157 29 100 16 273 13 237 189 98 190 211 39 97 73 275 172 173 125 175 111 106 138 38 47 243 70 233 124 223 163 72 2 215 219 169 33 151 26 129 255 117 217 213 141 95 277 4 41 90 239 196 199 164 276 166 133 262 254 149 14 57 61 56 181 142 253 53 154 251 179 252 188 122 176 218 170 23 92 158 259 245 165 171 272 44 21 74 131 241 257 184 248 101 99 105 226 198 264 271 110 265 78 113 54 232 102 63 212 187 103 43 9 180 225 118 119 260 201 242 145 46 86 48 191 268 88 182 50 261 274 159 229 6 52 258 210 84 65 193 162 10 203 263 134 59 25 107 167 132 224 127 269 140 8 137 147 204 66 197 109 153 31 238 266 17 116 126 104 206 205 194 270 202 236 121 250 120 256 209 220 42 128 221 228 > <PUBCHEM_MMFF94_PARTIAL_CHARGES> 49 1 -0.68 10 -0.29 11 -0.29 14 -0.14 15 0.14 16 0.14 17 -0.28 20 -0.15 21 -0.15 22 0.14 23 -0.14 24 -0.15 25 0.14 26 -0.15 27 -0.14 28 0.14 29 -0.15 3 0.28 30 -0.15 31 -0.15 32 -0.15 33 -0.14 34 -0.15 35 0.14 36 -0.14 37 -0.15 38 -0.15 39 -0.15 40 0.14 41 -0.15 5 0.42 52 0.15 55 0.15 6 -0.28 69 0.4 70 0.15 71 0.15 75 0.15 79 0.15 83 0.15 84 0.15 85 0.15 86 0.15 87 0.15 9 0.14 91 0.15 92 0.15 93 0.15 97 0.15 > <PUBCHEM_EFFECTIVE_ROTOR_COUNT> 11.6 > <PUBCHEM_PHARMACOPHORE_FEATURES> 10 1 1 acceptor 1 1 donor 1 25 hydrophobe 1 28 hydrophobe 1 35 hydrophobe 1 40 hydrophobe 3 2 7 8 hydrophobe 3 9 18 19 hydrophobe 6 2 3 4 5 6 10 rings 6 9 12 13 14 16 17 rings > <PUBCHEM_HEAVY_ATOM_COUNT> 41 > <PUBCHEM_ATOM_DEF_STEREO_COUNT> 1 > <PUBCHEM_ATOM_UDEF_STEREO_COUNT> 1 > <PUBCHEM_BOND_DEF_STEREO_COUNT> 9 > <PUBCHEM_BOND_UDEF_STEREO_COUNT> 0 > <PUBCHEM_ISOTOPIC_ATOM_COUNT> 0 > <PUBCHEM_COMPONENT_COUNT> 1 > <PUBCHEM_CACTVS_TAUTO_COUNT> 1 > <PUBCHEM_CONFORMER_ID> 016A02550000001B > <PUBCHEM_MMFF94_ENERGY> 103.8315 > <PUBCHEM_FEATURE_SELFOVERLAP> 50.75 > <PUBCHEM_SHAPE_FINGERPRINT> 11421887 21 18202003189592933545 11478447 183 17967534584698237428 11828042 53 17844817989355874945 12013929 2 18411699907493323889 14251920 17 8286201651768557187 15890870 6 18333450959021723274 16728433 110 18201719596738267064 23399689 5 9151170966622239018 3092352 35 18201999968039939471 3991529 128 14418132924842332209 57303763 176 18272655620006411505 57303763 39 13190348998417406665 9663363 56 17203327810139778379 > <PUBCHEM_SHAPE_MULTIPOLES> 837.89 87.46 2.88 1.2 0.25 0.78 -0.29 -22.56 -13.36 -3.86 0.55 3.59 0 -1.2 > <PUBCHEM_SHAPE_SELFOVERLAP> 1696.49 > <PUBCHEM_SHAPE_VOLUME> 487.7 > <PUBCHEM_COORDINATE_TYPE> 2 5 10 $$$$
Description
Classification	DIET > Carotenoids > Xanthophylls
CAS number	24480-38-4
PubChem ID	23724629
ChEBI ID	10223
FooDB ID	FDB015827
HMDB ID	HMDB02268

Biomarker measurements

Biomarkers
Biospecimens
Analytical methods
Cohorts
Publications

Title	First author	Year
Intraindividual variability in serum micronutrients: effects on reliability of estimated parameters	Shvetsov	2009

Analytical method
HPLC

Biospecimen
Plasma, fasting

Cohort
Cohort study of cervical human papillomavirus at the Cancer Research Center of Hawaii

Biomarker

Biomarker concentration values

ID	Parent ID	Depth	Subject group	Population	Country	Country code	Cohort	Biomarker Time definition	Biospecimen	Analytical method	Biomarker	Biomarker detail	Measurement size	Detected (nb)	Detected (%)	Detected only?	Arithmethic mean	Arithmethic SD	Geometric mean	Geometric SD	Min	Min (detected)	Percentile_05	Percentile_10	Percentile_25	Median	Percentile_75	Percentile_90	Percentile_95	Max	Interquartile range	Mean 95% CI lower	Mean 95% CI upper	GMean 95% CI lower	GMean 95% CI upper	Unit	Converted arithmetic mean	Converted geometric mean	Converted median	Converted unit	Adjustment type	Adjusted on	Regressed on	Expressed as	Publication

Intake values

No data available

Correlation values

No data available

Metabolomics data

No data available

Reproducibility values

ID	Mst. ID	Subject group	Population	Country	Country code	Cohort	Biomarker Time definition	Biospecimen	Analytical method	Biomarker	Biomarker detail	Arithmetic mean	Geometric mean	Median	Unit	Adjusted on	Reproducibility size	ICC	ICC 95% CI lower	ICC 95% CI upper	CV% WS	CV% BS	VAR WS	VAR BS	Publication