D-トリプトファン

D-トリプトファン · (R)-3-(1H-インドール-3-イル)-2-アミノプロパン酸 · (-)-トリプトファン · (R)-2-アミノ-3-(1H-インドール-3-イル)プロパン酸 · (αR)-α-アミノ-1H-インドール-3-プロパン酸 · (-)-D-トリプトファン · (R)-α-アミノ-1H-インドール-3-プロパン酸 · (R)-(+)-2-アミノ-3-(3-インドリル)プロピオン酸

https://huagongshe.com/ja/chemical/9060

識別子と物理属性

CAS No.	153-94-6
分子式	C11H12N2O2
平均分子量	204.22 g/mol
単同位体質量	204.08987762 g/mol
SMILES	N[C@H](Cc1c[nH]c2ccccc12)C(=O)O
InChIKey	QIVBCDIJIAJPQS-SECBINFHSA-N
PubChem CID	9060
ChEMBL	CHEMBL292303
ChEBI	CHEBI:16296
EC No.	205-819-9
DTXSID	DTXSID0046989
現地名	D-トリプトファン

化学・物理的性質

XLogP	-1.1
極性表面積	79.1
水素結合供与体数	3
水素結合受容体数	3
回転可能結合数	3
重原子数	15
形式電荷	0
複雑度	245
物質分類	Biological Agents -> Amino Acids and Derivatives
医薬品	Pharmaceuticals -> Listed in ZINC15
溶解度	1 to 5 mg/mL at 75 °F (NTP, 1992)水ベース (マイルド)、DMSO (マイルド、加熱、超音波処理)、メタノール (マイルド)11g/L（20℃）
融点	527 to 540 °F (NTP, 1992)282-85 dec °C282 - 85 °C282-285 °C (dec.)(lit.)
Physical Description	D(+)-tryptophan is a white solid. (NTP, 1992)[CAMEO] White powder[Alfa Aesar MSDS]
Collision Cross Section	151.5 Å² [M-H]- [CCS Type: DTBuffer gas: N2Ionization: ESI-Dataset: TOXCASTSource Identifier: DTXSID0046989]142.6 Å² [M-H]-
比旋光度	31.5 º (c=1, H2O 24 ºC)
沸点	342.72°C (rough estimate)
密度	1.1754 (rough estimate)
屈折率	31 ° (C=1, H2O)
貯蔵条件	Keep in dark place,Inert atmosphere,Room temperature
pKa（酸解離定数）	2.30±0.10(Predicted)
外観・状態	粉
色	白色～やや黄色
由来生物	synthetic (organic)
BRN	86198
安定性	安定。酸化剤と相容れない。
InChI	1S/C11H12N2O2/c12-9(11(14)15)5-7-6-13-10-4-2-1-3-8(7)10/h1-4,6,9,13H,5,12H2,(H,14,15)/t9-/m1/s1
InChIKey	QIVBCDIJIAJPQS-SECBINFHSA-N
SMILES	N[C@H](Cc1c[nH]c2ccccc12)C(O)=O
LogP（分配係数）	0.704 (est)
CAS データベース	153-94-6(CAS DataBase Reference)
EPAの化学物質情報	D-Tryptophan (153-94-6)

化学的特性

white powder

安全性と法規制

GHS 分類	This chemical does not meet GHS hazard criteria for 87.5% (7 of 8) of all reports.WarningH315 (12.5%): Causes skin irritation [Warning Skin corrosion/irritation]P261, P264, P264+P265, P271, P280, P302+P352, P304+P340, P305+P351+P338, P319, P321, P332+P317, P337+P317, P362+P364, P403+P233, P405, and P501 (click each P-code to see the statement)Aggregated GHS information provided per 8 reports by companies from 2 notifications to the ECHA C&L Inventory. Each notification may be associated with multiple companies.
規制情報	D-Tryptophan: Does not have an individual approval but may be used under an appropriate group standard
火災危険	Flash point data are not available for this chemical, but it is probably combustible. (NTP, 1992)
有害性の概要	Causes altered sleep time (including change in righting reflex), dyspnea, and decreased body temperature in intraperitoneal lethal-dose studies of rats (LD50 = 4,289 mg/kg)[RTECS] May cause irritation[Alfa Aesar MSDS]
反応性グループ	Salts, Acidic
Reactivity Profile	Acidic salts, such as D(+)-TRYPTOPHAN, are generally soluble in water. The resulting solutions contain moderate concentrations of hydrogen ions and have pH's of less than 7.0. They react as acids to neutralize bases. These neutralizations generate heat, but less or far less than is generated by neutralization of inorganic acids, inorganic oxoacids, and carboxylic acid. They usually do not react as either oxidizing agents or reducing agents but such behavior is not impossible. Many of these compounds catalyze organic reactions.
Air and Water Reactions	Slightly soluble in water.
Hazard Classes and Categories	Skin Irrit. 2 (12.5%)
消火	Fires involving this compound should be controlled using a dry chemical, carbon dioxide or Halon extinguisher. (NTP, 1992)
応急処置	EYES: First check the victim for contact lenses and remove if present. Flush victim's eyes with water or normal saline solution for 20 to 30 minutes while simultaneously calling a hospital or poison control center. Do not put any ointments, oils, or medication in the victim's eyes without specific instructions from a physician. IMMEDIATELY transport the victim after flushing eyes to a hospital even if no symptoms (such as redness or irritation) develop.

用途

使用

An essential amino acid found in naturally produced pedtides. Unlike its stereoisomer, L-tryptophan, it is not used in structural or enzyme proteins.

一般的な説明

White solid.