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(-)-Zingiberene

(-)-Zingiberene structure

CAS No:
495-60-3
Formula:
C15H24
Chemical Name:
(-)-Zingiberene
Synonyms:
1,3-Cyclohexadiene,5-[(1S)-1,5-dimethyl-4-hexen-1-yl]-2-methyl-,(5R)-;1,3-Cyclohexadiene,5-(1,5-dimethyl-4-hexenyl)-2-methyl-,[S-(R*,S*)]-;Zingiberene;1,3-Cyclohexadiene,5-[(1S)-1,5-dimethyl-4-hexenyl]-2-methyl-,(5R)-;(5R)-5-[(1S)-1,5-Dimethyl-4-hexen-1-yl]-2-methyl-1,3-cyclohexadiene;l-Zingiberene;(-)-Zingiberene;α-Zingiberene;α-Sesquiphellandrene;7785-34-4;22627-92-5
Categories:
Pharmaceutical Intermediates > Bulk Drug Intermediates

Description

Zingiberene is 2-Methylcyclohexa-1,3-diene in which a hydrogen at the 5 position is substituted (R configuration) by a 6-methyl-hept-5-en-2-yl group (S configuration). It is a sesquiterpene found in the dried rhizomes of Indonesian ginger, Zingiber officinale. It is a sesquiterpene and a cyclohexadiene. It is an enantiomer of an ent-zingiberene.

(-)-Zingiberene Basic Attributes

Molecular Weight：

204.35 g/mol

Exact Mass：

204.187800766 g/mol

EC Number：

207-804-2

UNII：

8XOC63EI5F

DSSTox ID：

DTXSID00197808

Characteristics

PSA：

0 Å²

Density：

0.8713 g/cm³ @ Temp: 20 °C

Boiling Point：

128-129 °C @ Press: 9 Torr

Drug Information

MeSH Entry Terms：

zingiberene

(-)-Zingiberene Use and Manufacturing

Use Classification：

Lipids -> Prenol Lipids [PR] -> Isoprenoids [PR01] -> C15 isoprenoids (sesquiterpenes) [PR0103]

Computed Properties

Molecular Weight:204.35
XLogP3:5.2
Rotatable Bond Count:4
Exact Mass:204.187800766
Monoisotopic Mass:204.187800766
Heavy Atom Count:15
Complexity:274
Defined Atom Stereocenter Count:2
Covalently-Bonded Unit Count:1
Compound Is Canonicalized:Yes

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[S-(R*,S*)]-5-(1,5-dimethylhexen-4-yl)-2-methyl-1,3-cyclohexa-1,3-diene

CAS No.: 495-60-3

Content: 99.00%

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