Products 4176-16-3

CAS 4176-16-3 is the registry number for Valerenal. Offered by: MedChemExpress. Available pack sizes: Get quote.

Valerenal
MedChemExpress
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  • Variants: 1
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Structural formula: {0} (CAS {1})

Valerenal is a sesquiterpenoid.

Source: ChEBI

Identity
Molecular formulaC15H22O
Molecular weight218.33 g/mol
IUPAC name(E)-3-[(4S,7R,7aR)-3,7-dimethyl-2,4,5,6,7,7a-hexahydro-1H-inden-4-yl]-2-methylprop-2-enal
InChIKeyRJZWGDPBGWGJNU-MTXIQXFFSA-N
SMILESC[C@@H]1CC[C@H](C2=C(CC[C@H]12)C)/C=C(\C)/C=O

Computed by PubChem (NCBI)

Synonyms: Valerenal, orb3179594
Isomers (same molecular formula)
1-phenylnonan-1-one C15H22O
4-(4-propylcyclohexyl)phenol C15H22O
[4-(4,4-dimethylcyclohexyl)phenyl]methanol C15H22O
2-methyl-1-(4-pentylphenyl)propan-1-one C15H22O
4-octylbenzaldehyde C15H22O
(4aS,7R)-1,4a-dimethyl-7-prop-1-en-2-yl-3,4,5,6,7,8-hexahydronaphthalen-2-one C15H22O
4-(4-propylcyclohexyl)phenol C15H22O
1-(4-tert-butylphenyl)-2-methylbutan-1-one C15H22O
(3E,7E)-3,7-dimethyl-10-propan-2-ylidenecyclodeca-3,7-dien-1-one C15H22O
(2E,6Z)-2,6-dimethyl-10-methylidenedodeca-2,6,11-trienal C15H22O
2,5-ditert-butylbenzaldehyde C15H22O
(3S,5R,8S)-3,8-dimethyl-5-prop-1-en-2-yl-3,4,5,6,7,8-hexahydro-2H-azulen-1-one C15H22O

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