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二氢麦角胺

CAS 511-12-6C33H37N5O5MW 583.7

二氢麦角胺(CAS 511-12-6):分子式 C33H37N5O5、分子量 583.7。

产品概览

CAS号511-12-6
分子式C33H37N5O5
分子量583.7
LogP2.4
应用领域Uses: Use (kg、approx.) in Germany (2009): >25、Consumption (g per capita、approx.) in Germany (2009): 0.000305、Calculated removal (%): 2.8、Dihydroergotamine is a 9、10alpha-dihydro derivative of ergotamine. It is used as a vasoconstrictor、specifically for the therapy of migraine disorders. Ergoline alkaloids occurs in various species of vines of the Convolvulaceae (morning glory) family and in some species of lower fungi. (L1918、L1932) For the acute treatment of migraine headaches with or without aura and the acute treatment of cluster headache episodes.、Use Classification: Pharmaceuticals

应用领域

登记用途:Uses: Use (kg、approx.) in Germany (2009): >25、Consumption (g per capita、approx.) in Germany (2009): 0.000305、Calculated removal (%): 2.8、Dihydroergotamine is a 9、10alpha-dihydro derivative of ergotamine. It is used as a vasoconstrictor、specifically for the therapy of migraine disorders. Ergoline alkaloids occurs in various species of vines of the Convolvulaceae (morning glory) family and in some species of lower fungi. (L1918、L1932) For the acute treatment of migraine headaches with or without aura and the acute treatment of cluster headache episodes.、Use Classification: Pharmaceuticals。

技术档案

这个产品是什么

二氢麦角胺 是一种化工化合物,登记 CAS 号为 511-12-6,分子式 C33H37N5O5(分子量 583.7)。

识别信息

登记 CAS 号:511-12-6

其分子式 C33H37N5O5 由 33 个碳、37 个氢、5 个氮、5 个氧 组成。

别名/同义词:二氢麦角胺 · dihydroergotamine

常见问题

二氢麦角胺 的 CAS 号是多少?

二氢麦角胺 的 CAS 登记号为 511-12-6。

二氢麦角胺 的分子式与分子量是多少?

分子式 C33H37N5O5,分子量 583.7。

二氢麦角胺 还有哪些别名?

别名/同义词:二氢麦角胺、dihydroergotamine。

二氢麦角胺 的登记用途是什么?

登记用途:Uses: Use (kg、approx.) in Germany (2009): >25、Consumption (g per capita、approx.) in Germany (2009): 0.000305、Calculated removal (%): 2.8、Dihydroergotamine is a 9、10alpha-dihydro derivative of ergotamine. It is used as a vasoconstrictor、specifically for the therapy of migraine disorders. Ergoline alkaloids occurs in various species of vines of the Convolvulaceae (morning glory) family and in some species of lower fungi. (L1918、L1932) For the acute treatment of migraine headaches with or without aura and the acute treatment of cluster headache episodes.、Use Classification: Pharmaceuticals。

PubChem 公开数据

二氢麦角胺(CAS 511-12-6)的独立参考数据,整理自公开化学数据库。

各数据库的登记标识

CAS Registry Number511-12-6
PubChem CID10531
Molecular formulaC33H37N5O5
IUPAC name(6aR,9R,10aR)-N-[(1S,2S,4R,7S)-7-benzyl-2-hydroxy-4-methyl-5,8-dioxo-3-oxa-6,9-diazatricyclo[7.3.0.02,6]dodecan-4-yl]-7-methyl-6,6a,8,9,10,10a-hexahydro-4H-indolo[4,3-fg]quinoline-9-carboxamide
UNII (FDA)436O5HM03C

计算分子描述符

Molecular Weight583.7
XLogP32.4
Hydrogen Bond Donor Count3
Hydrogen Bond Acceptor Count6
Rotatable Bond Count4
Exact Mass583.27946930
Monoisotopic Mass583.27946930
Topological Polar Surface Area118
Heavy Atom Count43

在册的理化数值

Solubility2.29e-01 g/L

在册的记载用途

    Use (kg; approx.) in Germany (2009): >25Consumption (g per capita; approx.) in Germany (2009): 0.000305

    同义词与商品名

    dihydroergotamine; 511-12-6; 9,10-Dihydroergotamine; Dihidroergotamina; Dihydroergotaminum; Neomigran; Diidroergotamina; Agit; MAP0004; DTXSID6045614; MAP-0004; 436O5HM03C; CHEBI:4562; DTXCID4025614; 5'-Benzyl-12'-hydroxy-2'-methyl-3',6',18-trioxo-9,10-dihydroergotaman; 9,10-Dihydro-12'-hydroxy-2'-methyl-5'-(phenylmethyl)ergotoman-3',6',18-trione

    GHS 危害分类

    Reported hazard statementsH302 (66.7%), H312 (33.3%), H332 (66.7%)

    H302 (66.7%): Harmful if swallowed [Warning Acute toxicity, oral]

    H312 (33.3%): Harmful in contact with skin [Warning Acute toxicity, dermal]

    公开数据库对它的描述

    dihydroergotamine · CAS 511-12-6 · C33H37N5O5. UNII 436O5HM03C. Solubility: 2.29e-01 g/L.

    物理形态与操作说明

    数据来源:PubChem / Wikidata;与随货 COA 不一致时以 COA 为准。

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