NEOXANTHIN

Details

Stereochemistry	ABSOLUTE
Molecular Formula	C40H56O4
Molecular Weight	600.8702
Optical Activity	UNSPECIFIED
Additional Stereochemistry	Yes
Defined Stereocenters	5 / 5
E/Z Centers	10
Charge	0
Stereo Comments	AXIAL, R

SHOW SMILES / InChI

Structure Search

SMILES

CC(/C=C/C=C(C)\C=C\[C@@]12O[C@]1(C)C[C@@H](O)CC2(C)C)=C\C=C\C=C(C)\C=C\C=C(/C)C=C=C3C(C)(C)C[C@H](O)C[C@@]3(C)O

InChI

InChIKey=PGYAYSRVSAJXTE-OQASCVKESA-N

InChI=1S/C40H56O4/c1-29(17-13-19-31(3)21-22-35-36(5,6)25-33(41)27-38(35,9)43)15-11-12-16-30(2)18-14-20-32(4)23-24-40-37(7,8)26-34(42)28-39(40,10)44-40/h11-21,23-24,33-34,41-43H,25-28H2,1-10H3/b12-11+,17-13+,18-14+,24-23+,29-15+,30-16+,31-19+,32-20-/t22-,33-,34-,38+,39+,40-/m0/s1

HIDE SMILES / InChI

Molecular Formula	C40H56O4
Molecular Weight	600.8702
Charge	0
Count

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

Approval Year

PubMed

Title	Date	PubMed
A highly polar xanthophyll of 9'-cis-neoxanthin induces apoptosis in HCT116 human colon cancer cells through mitochondrial dysfunction.	2007-06	17186379
Identification of carotenoids in ovarian tissue in women.	2005-11	16211314

Patents

Substance Class	Chemical Created by `admin` on `Mon Mar 31 19:52:35 GMT 2025` Edited by `admin` on `Mon Mar 31 19:52:35 GMT 2025`
Record UNII	KK8M5T48AI
Record Status	`Validated (UNII)`
Record Version

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Name

Type

Language

NEOXANTHIN

Common Name

English

(1R,3R)-6-((3E,5E,7E,9E,11E,13E,15E,17E)-18-((1S,4R,6R)-4-HYDROXY-2,2,6-TRIMETHYL-7-OXABICYCLO(4.1.0)HEPT-1-YL)-3,7,12,16-TETRAMETHYLOCTADECA-1,3,5,7,9,11,13,15,17-NONAENYLIDENE)-1,5,5-TRIMETHYLCYCLOHEXANE-1,3-DIOL

Preferred Name

English

9-CIS-NEOXANTHIN

Common Name

English

9'-CIS-NEOXANTHIN

Common Name

English

(3S,5R,6R,3'S,5'R,6'S)-5',6'-EPOXY-6,7-DIDEHYDRO- 5,6,5',6'-TETRAHYDRO-.BETA.,.BETA.-CAROTENE-3,5,3'-TRIOL, 9'-CIS-NEOXANTHIN

Common Name

English

.BETA.,.BETA.-CAROTENE-3,3',5(6H)-TRIOL, 6,7-DIDEHYDRO-5',6'-EPOXY-5',6'-DIHYDRO-, (3S,3'S,5R,5'R,6R,6'S,9'-CIS)-

Systematic Name

English

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

Common Name

English

CIS-NEOXANTHIN

Common Name

English

(9'Z)-NEOXANTHIN

Common Name

English

.BETA.,.BETA.-CAROTENE, 6,7-DIDEHYDRO-5',6'-EPOXY-5,5',6,6'-TETRAHYDRO-3,3',5-TRIHYDROXY-, (3S,3'S,5R,5'R,6R,6'S,9'-CIS)-

Common Name

English

9'Z-(6R)-NEOXANTHIN

Common Name

English

FOLIAXANTHIN

Common Name

English

NEOXANTHINE

Common Name

English

(3S,3'S,5R,5'R,6'S,9'CIS)-6,7-DIDEHYDRO-5,5',6,6'-TETRAHYDRO-5',6'-EPOXY-.BETA.,.BETA.-CAROTENE-3,3',5-TRIOL

Common Name

English

Code System Code Type Description

WIKIPEDIA

NEOXANTHIN