Products 514-92-1

CAS 514-92-1 is the registry number for Torularhodin. Offered by: Biosynth, MedChemExpress. Available pack sizes: 2mg, 1mg, 5mg, Get quote.

Torularhodin
Biosynth, MedChemExpress
  • size: 2mg, 1mg, 5mg, Get quote
  • Variants: 4
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Structural formula: {0} (CAS {1})

Torularhodin is a xanthophyll.

Source: ChEBI

Identity
Molecular formulaC40H52O2
Molecular weight564.8 g/mol
IUPAC name(2E,4E,6E,8E,10E,12E,14E,16E,18E,20E,22E,24E)-2,6,10,14,19,23-hexamethyl-25-(2,6,6-trimethylcyclohexen-1-yl)pentacosa-2,4,6,8,10,12,14,16,18,20,22,24-dodecaenoic acid
InChIKeyNESPPCWGYRQEJQ-VATUXEBJSA-N
SMILESCC1=C(C(CCC1)(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=C(\C)/C(=O)O)/C)/C

Computed by PubChem (NCBI)

Synonyms: Torularhodin, (3'E)-3',4'-Didehydro-beta,psi-caroten-16'-oic acid, Torularhodine, beta,psi-Caroten-16'-oic acid, 3',4'-didehydro-, (3'E)-, TORULARODINE, TORULARHODIN [MI], ALL-TRANS-TORULARHODIN, orb3141699, NESPPCWGYRQEJQ-VATUXEBJSA-N, 3',4'-Didehydro-b,?-caroten-16'-oic acid
Isomers (same molecular formula)
2,4,4-trimethyl-3-[(1E,3E,5E,7E,9E,11E,13E,15E,17E)-3,7,12,16-tetramethyl-18-(2,6,6-trimethyl-3-oxocyclohexen-1-yl)octadeca-1,3,5,7,9,11,13,15,17-nonaenyl]cyclohex-2-en-1-one C40H52O2
(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 C40H52O2
2,4,4-trimethyl-3-[(1E,3E,5E,7E,9E,11E,13E,15Z,17E)-3,7,12,16-tetramethyl-18-(2,6,6-trimethyl-3-oxocyclohexen-1-yl)octadeca-1,3,5,7,9,11,13,15,17-nonaenyl]cyclohex-2-en-1-one C40H52O2
2,4,4-trimethyl-3-[(1E,3E,5E,7E,9E,11Z,13E,15E,17E)-3,7,12,16-tetramethyl-18-(2,6,6-trimethyl-3-oxocyclohexen-1-yl)octadeca-1,3,5,7,9,11,13,15,17-nonaenyl]cyclohex-2-en-1-one C40H52O2