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

Details

Stereochemistry ACHIRAL
Molecular Formula C40H52O
Molecular Weight 548.8403
Optical Activity NONE
Defined Stereocenters 0 / 0
E/Z Centers 12
Charge 0

SHOW SMILES / InChI
Structure of TORULARHODINALDEHYDE

SMILES

C\C(C=O)=C/C=C/C(C)=C/C=C/C(C)=C/C=C/C(C)=C/C=C/C=C(C)/C=C/C=C(C)/C=C/C1=C(C)CCCC1(C)C

InChI

InChIKey=IAEFJGPZEPGPGJ-HMHVFHPLSA-N
InChI=1S/C40H52O/c1-32(19-12-21-34(3)22-13-23-35(4)24-15-26-37(6)31-41)17-10-11-18-33(2)20-14-25-36(5)28-29-39-38(7)27-16-30-40(39,8)9/h10-15,17-26,28-29,31H,16,27,30H2,1-9H3/b11-10+,19-12+,20-14+,22-13+,24-15+,29-28+,32-17+,33-18+,34-21+,35-23+,36-25+,37-26+

HIDE SMILES / InChI

Molecular Formula C40H52O
Molecular Weight 548.8403
Charge 0
Count
Stereochemistry ACHIRAL
Additional Stereochemistry No
Defined Stereocenters 0 / 0
E/Z Centers 12
Optical Activity NONE

Approval Year

Substance Class Chemical
Created
by admin
on Sat Dec 16 09:12:40 GMT 2023
Edited
by admin
on Sat Dec 16 09:12:40 GMT 2023
Record UNII
11EXT0X0KN
Record Status Validated (UNII)
Record Version
  • Download
Name Type Language
TORULARHODINALDEHYDE
Common Name English
(2E,4E,6E,8E,10E,12E,14E,16E,18E,20E,22E,24E)-2,6,10,14,19,23-HEXAMETHYL-25-(2,6,6-TRIMETHYL-1-CYCLOHEXEN-1-YL)-2,4,6,8,10,12,14,16,18,20,22,24-PENTACOSADODECAENAL
Systematic Name English
.GAMMA.-CAROTEN-16'-AL, 3',4'-DIDEHYDRO-
Common Name English
.BETA.,.PSI.-CAROTEN-16'-AL, 3',4'-DIDEHYDRO-
Common Name English
.GAMMA.-CAROTENAL, 3',4'-DIDEHYDRO-
Common Name English
2,4,6,8,10,12,14,16,18,20,22,24-PENTACOSADODECAENAL, 2,6,10,14,19,23-HEXAMETHYL-25-(2,6,6-TRIMETHYL-1-CYCLOHEXEN-1-YL)-, (2E,4E,6E,8E,10E,12E,14E,16E,18E,20E,22E,24E)-
Systematic Name English
Code System Code Type Description
CAS
5999-29-1
Created by admin on Sat Dec 16 09:12:40 GMT 2023 , Edited by admin on Sat Dec 16 09:12:40 GMT 2023
PRIMARY
FDA UNII
11EXT0X0KN
Created by admin on Sat Dec 16 09:12:40 GMT 2023 , Edited by admin on Sat Dec 16 09:12:40 GMT 2023
PRIMARY
PUBCHEM
20056893
Created by admin on Sat Dec 16 09:12:40 GMT 2023 , Edited by admin on Sat Dec 16 09:12:40 GMT 2023
PRIMARY