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04626

Supelco

Hop-22(29)-ene solution

0.1 mg/mL in isooctane, analytical standard

Synonym(s):

Diploptene

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About This Item

Empirical Formula (Hill Notation):
C30H50
CAS Number:
1615-91-4
Molecular Weight:
410.72
EC Number:
208-759-1
MDL number:
MFCD00216319
UNSPSC Code:
85151701
PubChem Substance ID:
329747961
NACRES:
NA.24

grade

analytical standard

Quality Level

100

shelf life

limited shelf life, expiry date on the label

concentration

0.1 mg/mL in isooctane
100 μg/mL in isooctane

application(s)

food and beverages

format

single component solution

storage temp.

−20°C

SMILES string

[H][C@@]12CC[C@]3(C)[C@]([H])(CC[C@]4([H])[C@@]5(C)CCCC(C)(C)[C@]5([H])CC[C@@]34C)[C@@]1(C)CC[C@@H]2C(C)=C

InChI

1S/C30H50/c1-20(2)21-12-17-27(5)22(21)13-18-29(7)24(27)10-11-25-28(6)16-9-15-26(3,4)23(28)14-19-30(25,29)8/h21-25H,1,9-19H2,2-8H3/t21-,22+,23+,24-,25-,27+,28+,29-,30-/m1/s1

InChI key

HHXYJYBYNZMZKX-PYQRSULMSA-N

General description

Certan Vial

Signal Word

Danger

Hazard Statements

H225,H304,H315,H336,H410

Hazard Classifications

Aquatic Acute 1 - Aquatic Chronic 1 - Asp. Tox. 1 - Flam. Liq. 2 - Skin Irrit. 2 - STOT SE 3

Target Organs

Central nervous system

Storage Class Code

3 - Flammable liquids

WGK

WGK 2

Flash Point(F)

10.4 °F - closed cup

Flash Point(C)

-12 °C - closed cup

Personal Protective Equipment

dust mask type N95 (US), Eyeshields, Gloves

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Certificates of Analysis (COA)

Lot/Batch Number
BCCL4637
BCCG6076
BCCD9044
BCBZ9207
BCBW3243

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Tsutomu Sato et al.
Bioscience, biotechnology, and biochemistry, 68(3), 728-738 (2004-04-02)
To provide insight into the catalytic mechanism for the final deprotonation reaction of squalene-hopene cyclase (SHC) from Alicyclobacillus acidocaldarius, mutagenesis experiments were conducted for the following ten residues: Thr41, Glu45, Glu93, Arg127, Trp133, Gln262, Pro263, Tyr267, Phe434 and Phe437. An
B Andes Hess et al.
Organic letters, 6(11), 1717-1720 (2004-05-21)
The cyclization of the A-B rings of squalene to hopene is studied computationally (DFT). A transition structure is found for a concerted, asynchronous pathway for the formation of chair-chair decalin carbocation. The computationally derived conformer leading to this asynchronous transition
Dirk J Reinert et al.
Chemistry & biology, 11(1), 121-126 (2004-04-29)
The membrane protein squalene-hopene cyclase was cocrystallized with 2-azasqualene and analyzed by X-ray diffraction to 2.13 A resolution. The conformation of this close analog was clearly established, and it agreed with the common textbook presentation. The bound squalene undergoes only
H Schulenberg-Schell et al.
Analytical biochemistry, 181(1), 120-124 (1989-08-15)
A rapid and sensitive method for determination of various hopanoids in microorganisms is described. Tetrahydroxybacteriohopane (THBH), THBH-ether and -glycoside were acetylated with acetanhydride/pyridine and were separated on a C18 reversed-phase HPLC column with a gradient of acetonitrile in methanol and
M Vyssotski et al.
Lipids, 46(12), 1155-1161 (2011-08-02)
A Gram-negative, aerobic, pink-pigmented, rod-shaped bacterium Chthonomonas calidirosea (strain T49(T)) with an optimal temperature for growth of 68 °C, isolated from soil samples from Hell's Gate in the Tikitere geothermal system (New Zealand), was the first cultivated bacterium of the novel
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