DINOXANTHIN

Details

Stereochemistry	ABSOLUTE
Molecular Formula	C42H58O5
Molecular Weight	642.9069
Optical Activity	UNSPECIFIED
Defined Stereocenters	5 / 5
E/Z Centers	10
Charge	0

SHOW SMILES / InChI

Structure Search

SMILES

CC(=O)O[C@H]1CC(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@@]23O[C@]2(C)C[C@@H](O)CC3(C)C)[C@](C)(O)C1

InChI

InChIKey=PVNVIBOWBAPFOE-AJSXGTQYSA-N

InChI=1S/C42H58O5/c1-30(18-14-20-32(3)22-23-37-38(6,7)28-36(46-34(5)43)29-40(37,10)45)16-12-13-17-31(2)19-15-21-33(4)24-25-42-39(8,9)26-35(44)27-41(42,11)47-42/h12-22,24-25,35-36,44-45H,26-29H2,1-11H3/b13-12+,18-14+,19-15+,25-24+,30-16+,31-17+,32-20+,33-21+/t23-,35+,36+,40-,41-,42+/m1/s1

HIDE SMILES / InChI

Molecular Formula	C42H58O5
Molecular Weight	642.9069
Charge	0
Count

Stereochemistry	ABSOLUTE
Additional Stereochemistry	No
Defined Stereocenters	5 / 5
E/Z Centers	10
Optical Activity	UNSPECIFIED

Approval Year

Substance Class	Chemical Created by `admin` on `Sat Dec 16 17:30:56 GMT 2023` Edited by `admin` on `Sat Dec 16 17:30:56 GMT 2023`
Record UNII	3QQ722WU3N
Record Status	`Validated (UNII)`
Record Version

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Name

Type

Language

DINOXANTHIN

Common Name

English

.BETA.,.BETA.-CAROTENE, 3-(ACETYLOXY)-6,7-DIDEHYDRO-5',6'-EPOXY-5,5',6,6'-TETRAHYDRO-3',5-DIHYDROXY-, (3S,3'S,5R,5'R,6S,6'S)-

Systematic Name

English

Code System Code Type Description

PUBCHEM

71308184