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ERGOCRISTINE

Name: ERGOCRISTINE
Brand: 2A Biotech
SKU: 2A-1177721

CAS Number511-08-0

Synonymsergocrystine; (5'α)-5'-Benzyl-12'-hydroxy-2'-isopropyl-3',6',18-trioxoergotaman; (5'α)-5'-benzyl-12'-hydroxy-3',6',18-trioxo-2'-(propan-2-yl)ergotaman; 5'-benzyl-12'-hydroxy-2'-isopropyl-ergotamane-18,3',6'-trione; (5'a)-12'-Hydroxy-2'-(1-methylethyl)-5'-(phenylmethyl)ergotaman-3',6',18-trione; Ergocristine

Molecular FormulaC35H39N5O5

Molecular Weight609.71

Purity≥95.0 (HPLC)%

Density1.5±0.1 g/cm3

Boiling Point886.0±75.0 °C at 760 mmHg

Melting Point155-157 °C (lit.)

EINECS208-120-7

MSDSChinese English

Symbol

Signal WordWarning

Cat. No.: 2A-1177721 Purity: ≥95.0 (HPLC)%

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Quality Control of [ 511-08-0 ] Purity: ≥95.0 (HPLC)% SDS Specification MoL

Chemical & Physical Properties
CAS Number	511-08-0
Catalog No.	2A-1177721
Chinese Name	麦角日亭宁麦角生物碱
Synonyms	ergocrystine; (5'α)-5'-Benzyl-12'-hydroxy-2'-isopropyl-3',6',18-trioxoergotaman; (5'α)-5'-benzyl-12'-hydroxy-3',6',18-trioxo-2'-(propan-2-yl)ergotaman; 5'-benzyl-12'-hydroxy-2'-isopropyl-ergotamane-18,3',6'-trione; (5'a)-12'-Hydroxy-2'-(1-methylethyl)-5'-(phenylmethyl)ergotaman-3',6',18-trione; Ergocristine
Molecular Formula	C35H39N5O5
Molecular Weight	609.71
Purity	≥95.0 (HPLC)
Density	1.5±0.1 g/cm3
Boiling Point	886.0±75.0 °C at 760 mmHg
Melting Point	155-157 °C (lit.)
Packaging	III
EINECS	208-120-7
MDL Number	MFCD00215848
SMILES	CC(C)[C@@]5(NC(=O)[C@H]1CN(C)[C@@H]2Cc3c[nH]c4cccc(C2=C1)c34)O[C@@]6(O)[C@@H]7CCCN7C(=O)[C@H](Cc8ccccc8)N6C5=O
InChI	1S/C35H39N5O5/c1-20(2)34(37-31(41)23-16-25-24-11-7-12-26-30(24)22(18-36-26)17-27(25)38(3)19-23)33(43)40-28(15-21-9-5-4-6-10-21)32(42)39-14-8-13-29(39)35(40,44)45-34/h4-7,9-12,16,18,20,23,27-29,36,44H,8,13-15,17,19H2,1-3H3,(H,37,41)/t23-,27-,28+,29+,34-,35+/m1/s1
InChI Key	HEFIYUQVAZFDEE-MKTPKCENSA-N
NACRES Code	NA.24
UNSPSC	41116107
Hazard Symbols	6.1(b)
Transport Info	Product name: Ergocristinephyproof(R)ReferenceSubstance

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ERGOCRISTINE

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