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

Details

Stereochemistry ABSOLUTE
Molecular Formula C40H54O3
Molecular Weight 582.855
Optical Activity UNSPECIFIED
Defined Stereocenters 2 / 2
E/Z Centers 9
Charge 0

SHOW SMILES / InChI
Structure of DORADEXANTHIN

SMILES

CC(\C=C\C=C(C)\C=C\C1=C(C)C[C@@H](O)CC1(C)C)=C/C=C/C=C(C)/C=C/C=C(C)/C=C/C2=C(C)C(=O)[C@@H](O)CC2(C)C

InChI

InChIKey=YECXHLPYMXGEBI-ZNQVSPAOSA-N
InChI=1S/C40H54O3/c1-28(17-13-19-30(3)21-23-35-32(5)25-34(41)26-39(35,7)8)15-11-12-16-29(2)18-14-20-31(4)22-24-36-33(6)38(43)37(42)27-40(36,9)10/h11-24,34,37,41-42H,25-27H2,1-10H3/b12-11+,17-13+,18-14+,23-21+,24-22+,28-15+,29-16+,30-19+,31-20+/t34-,37+/m1/s1

HIDE SMILES / InChI

Molecular Formula C40H54O3
Molecular Weight 582.855
Charge 0
Count
Stereochemistry ABSOLUTE
Additional Stereochemistry No
Defined Stereocenters 2 / 2
E/Z Centers 9
Optical Activity UNSPECIFIED

Approval Year

Substance Class Chemical
Created
by admin
on Sat Dec 16 10:31:40 GMT 2023
Edited
by admin
on Sat Dec 16 10:31:40 GMT 2023
Record UNII
PSZ3Q7662U
Record Status Validated (UNII)
Record Version
  • Download
Name Type Language
DORADEXANTHIN
Common Name English
ALL-TRANS-.BETA.-DORADEXANTHIN
Common Name English
.BETA.-CAROTEN-4-ONE, 3,3'-DIHYDROXY-
Systematic Name English
ADONIXANTHIN
Common Name English
(3S,3'R)-4-KETO-ZEAXANTHIN
Common Name English
.BETA.-DORADEXANTHIN
Common Name English
4-KETO-ZEAXANTHIN
Common Name English
.BETA.,.BETA.-CAROTEN-4-ONE, 3,3'-DIHYDROXY-, (3S,3'R)-
Systematic Name English
(3S,3'R)-3,3'-DIHYDROXY-.BETA.,.BETA.-CAROTEN-4-ONE
Systematic Name English
3,3'-DIHYDROXYECHINENONE
Common Name English
(3S,3'R)-ADONIXANTHIN
Common Name English
Code System Code Type Description
CHEBI
80217
Created by admin on Sat Dec 16 10:31:40 GMT 2023 , Edited by admin on Sat Dec 16 10:31:40 GMT 2023
PRIMARY
FDA UNII
PSZ3Q7662U
Created by admin on Sat Dec 16 10:31:40 GMT 2023 , Edited by admin on Sat Dec 16 10:31:40 GMT 2023
PRIMARY
PUBCHEM
16061189
Created by admin on Sat Dec 16 10:31:40 GMT 2023 , Edited by admin on Sat Dec 16 10:31:40 GMT 2023
PRIMARY
CAS
4418-73-9
Created by admin on Sat Dec 16 10:31:40 GMT 2023 , Edited by admin on Sat Dec 16 10:31:40 GMT 2023
PRIMARY
EPA CompTox
DTXSID10361750
Created by admin on Sat Dec 16 10:31:40 GMT 2023 , Edited by admin on Sat Dec 16 10:31:40 GMT 2023
PRIMARY