Paprika extract(CAS 465-42-9)的公开数据库记录,列此仅供独立核对。
危险化学品分类与危害说明
| GHS notification summary | 100% (11 / 11) |
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This chemical does not meet GHS hazard criteria for 100% (11 of 11) of all reports.
Reported as not meeting GHS hazard criteria by 11 of 11 companies. For more detailed information, please visit ECHA C&L website.
法规与备案状态
| Regulatory & Food Contact | CIR / INCI: Cosmetic colorant |
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| GHS notification summary | 100% (11 / 11) |
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物理形态与操作说明
- Deep carmine-red needles from petroleum ether
- In water, 3.41X10-10 mg/L at 25 °C (estimated)
- Freely soluble in acetone, chloroform; soluble in methanol, ethanol, ether and benzene; slightly soluble in petroleum ether and carbon disulfide.
- 4.65X10-18 mm Hg at 25 °C (estimated)
- Henry's law constant = 2.9X10-8 cu m-atm/mol at 25 °C (estimated)
- When heated to decomposition it emits acrid smoke and irritating fumes.
公开数据库收录的理化数据
这个物质在各数据库里的编号
| CAS Registry Number | 465-42-9 |
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| PubChem CID | 5281228 |
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| 分子式 | C40H56O3 |
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| IUPAC 名称 | (2E,4E,6E,8E,10E,12E,14E,16E,18E)-19-[(4R)-4-hydroxy-2,6,6-trimethylcyclohexen-1-yl]-1-[(1R,4S)-4-hydroxy-1,2,2-trimethylcyclopentyl]-4,8,13,17-tetramethylnonadeca-2,4,6,8,10,12,14,16,18-nonaen-1-one |
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| UNII(FDA) | 420NY1J57N |
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数据库记载的用途
- Used as an orange food color, E 160(c)
- The pharmacokinetics of dietary capsanthin were determined in four male volunteers with plasma essentially free of capsanthin at the beginning of the study. They received paprika juice for 1 week, equivalent to three doses of 5.4 umol capsanthin/day, for a total of 16.2 umol/day. The level of capsanthin in plasma reached a plateau (0.10-0.12 umol/L) between day 2 and day 7, and capsanthin was not detectable in plasma by day 16. Capsanthin was distributed in the plasma lipoproteins after 1 week as follows: very low
- The bioavailability of carotenoids from a paprika oleoresin (zeaxanthin, beta- cryptoxanthin, beta-carotene, capsanthin, capsorubin) was assessed in humans. After overnight fasting, nine volunteers ingested a single dose of a paprika oleoresin containing 6.4 mg zeaxanthin, 4.2 mg beta-cryptoxanthin, 6.2 mg beta-carotene, 35.0 mg capsanthin and 2.0 mg capsorubin. At different time points, the carotenoid pattern in the chylomicron fraction of whole blood was analyzed to evaluate carotenoid absorption. From the major
- /A/ study in which rats were gavaged with a mixture of capsaicinoids /was reported/. These substances were extensively metabolized by a variety of metabolic pathways, including 1) hydrolysis of the acid-amide bond and deamination to form vanillylamine, 2) hydroxylation of the vanillyl ring, 3) oxidation of the hydroxyl group in the ring and 4) oxidation of the terminal carbon in the sidechain. /Capsaicinoids/
- Later steps of carotenoid biosynthesis catalyzed by cyclase enzymes involve the formation of alpha, beta, and kappa-rings. Examination of the primary structure of lycopene beta-cyclase revealed 55% identity with that of antheraxanthin kappa-cyclase. Recombinant lycopene beta-cyclase afforded only beta-carotene, while recombinant antheraxanthin kappa-cyclase catalyzed the formation of beta-carotene from lycopene as well as the conversion of antheraxanthin into the kappa-carotenoid capsanthin. Since the formation of
- ... In a /study/ involving the single ingestion of paprika juice (equivalent to 34.2 umol capsanthin) The half-lives /after a single ingestion of paprika juice (equivalent to 34.2 umol capsanthin)/ were calculated to be 20.1 +/- 1.3 hr for capsanthin and 222 +/- 15 hr for lycopene. ...
它在各数据库里的别名
Capsanthin; 465-42-9; all-trans-capsanthin; Capsanthin/capsorubin; (3R,3'S,5'R)-3,3'-Dihydroxy-beta,kappa-caroten-6'-one; DTXSID10905012; 420NY1J57N; beta,kappa-Caroten-6'one, 3,3'dihydroxy-; CHEBI:3375; RefChem:31613; DTXCID401334125; 207-364-1; MFCD31726206; 3,3'-Dihydroxy-beta,kappa-caroten-6'one; all trans Capsanthin; EINECS 207-364-1
计算机算出的分子描述符
| 分子量 | 584.9 |
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| XLogP3 | 10.6 |
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| 氢键供体数 | 2 |
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| 氢键受体数 | 3 |
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| 可旋转键数 | 11 |
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| 精确质量 | 584.42294564 |
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| 单同位素质量 | 584.42294564 |
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| 拓扑极性表面积 | 57.5 |
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| 重原子数 | 43 |
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| 形式电荷 | 0 |
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数据库摘要
Paprika extract · CAS 465-42-9 · C40H56O3. UNII 420NY1J57N. 熔点: 176 °C.
数据来源:PubChem / Wikidata;与随货 COA 不一致时以 COA 为准。