U.S. Department of Health & Human Services Divider Arrow National Institutes of Health Divider Arrow NCATS

Details

Stereochemistry ABSOLUTE
Molecular Formula C40H52O2
Molecular Weight 564.8397
Optical Activity UNSPECIFIED
Defined Stereocenters 2 / 2
E/Z Centers 7
Charge 0

SHOW SMILES / InChI
Structure of ALLOXANTHIN

SMILES

CC(\C=C\C=C(/C)C#CC1=C(C)C[C@@H](O)CC1(C)C)=C/C=C/C=C(C)/C=C/C=C(\C)C#CC2=C(C)C[C@@H](O)CC2(C)C

InChI

InChIKey=DVICWXUADSCSLL-DDEWRDOISA-N
InChI=1S/C40H52O2/c1-29(17-13-19-31(3)21-23-37-33(5)25-35(41)27-39(37,7)8)15-11-12-16-30(2)18-14-20-32(4)22-24-38-34(6)26-36(42)28-40(38,9)10/h11-20,35-36,41-42H,25-28H2,1-10H3/b12-11+,17-13+,18-14+,29-15+,30-16+,31-19+,32-20+/t35-,36-/m1/s1

HIDE SMILES / InChI

Approval Year

Name Type Language
ALLOXANTHIN
Common Name English
ALLOXANTHIN (CONSTITUENT OF SPIRULINA) [DSC]
Common Name English
TETRADEHYDROZEAXANTHIN
Common Name English
(1R)-4-((3E,5E,7E,9E,11E,13E,15E)-18-((4R)-4-HYDROXY-2,6,6-TRIMETHYLCYCLOHEXEN-1-YL)-3,7,12,16-TETRAMETHYLOCTADECA-3,5,7,9,11,13,15-HEPTAEN-1,17-DIYNYL)-3,5,5-TRIMETHYLCYCLOHEX-3-EN-1-OL
Systematic Name English
.BETA.,.BETA.-CAROTENE-3,3'-DIOL, 7,7',8,8'-TETRADEHYDRO-, (3R,3'R)-
Common Name English
7,7',8,8'-TETRAHYDRO-BETA,BETA-CAROTENE-3,3'-DIOLBETA,BETA-CAROTENE-3,3'-DIOL, 7,7',8,8'-TETRADEHYDRO-, (3R,3'R)-
Common Name English
.BETA.-CAROTENE-3,3'-DIOL, 7,7',8,8'-TETRADEHYDRO-, (3R,3'R)-ALL-TRANS-
Common Name English
CRYPTOMONAXANTHIN
Common Name English
CYNTHIAXANTHIN
Common Name English
PECTENOXANTHIN
Common Name English
(1R,1'R)-4,4'-((3E,5E,7E,9E,11E,13E,15E)-3,7,12,16-TETRAMETHYLOCTADECA-3,5,7,9,11,13,15-HEPTAEN-1,17-DIYNE-1,18-DIYL)BIS(3,5,5-TRIMETHYLCYCLOHEX-3-EN-1-OL)
Systematic Name English
(3R,3'R)-7,7',8,8'-TETRADEHYDRO-.BETA.,.BETA.-CAROTENE-3,3'-DIOL
Common Name English
ALL-TRANS-ALLOXANTHIN
Common Name English
(3R,3'R)-ALLOXANTHIN
Common Name English
Code System Code Type Description
EPA CompTox
DTXSID801321358
Created by admin on Sat Dec 16 11:10:51 GMT 2023 , Edited by admin on Sat Dec 16 11:10:51 GMT 2023
PRIMARY
CAS
28380-31-6
Created by admin on Sat Dec 16 11:10:51 GMT 2023 , Edited by admin on Sat Dec 16 11:10:51 GMT 2023
PRIMARY
FDA UNII
G15L7OO8SQ
Created by admin on Sat Dec 16 11:10:51 GMT 2023 , Edited by admin on Sat Dec 16 11:10:51 GMT 2023
PRIMARY
PUBCHEM
6443740
Created by admin on Sat Dec 16 11:10:51 GMT 2023 , Edited by admin on Sat Dec 16 11:10:51 GMT 2023
PRIMARY