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Dihydro-alpha-ergocryptine mesylate structure, CAS 14271-05-7

Dihydro-alpha-ergocryptine mesylate

CAS Number14271-05-7

SynonymsErgocristine,dihydro; Ergocristine,9,10-dihydro; dihydro-alpha-ergocryptine mesylate; Dihydroergocristine; 12'-hydroxy-5'-isobutyl-2'-isopropyl-9,10-dihydro-ergotamane-18,3',6'-trione; 9,10-Dihydroergokryptine; 9,10-Dihydroergocristine

Molecular FormulaC33H47N5O8S

Molecular Weight673.82000

Purity98.00%

Density

Boiling Point848.7ºC at 760 mmHg

Melting Point

Flash Point

Appearance

EINECS

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Symbol

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Cat. No.: 2A-1182082 Purity: 98.00%
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Quality Control of [ 14271-05-7 ] Purity: 98.00% SDS Specification MoL

COA NMR CNMR HPLC LC-MS
Chemical & Physical Properties
CAS Number14271-05-7
Catalog No.2A-1182082
Chinese Name9,10α-dihydro-12'-hydroxy-5'α-isobutyl-2'-isopropylergotaman-3',6',18-trione monomethanesulphonate
SynonymsErgocristine,dihydro; Ergocristine,9,10-dihydro; dihydro-alpha-ergocryptine mesylate; Dihydroergocristine; 12'-hydroxy-5'-isobutyl-2'-isopropyl-9,10-dihydro-ergotamane-18,3',6'-trione; 9,10-Dihydroergokryptine; 9,10-Dihydroergocristine
Molecular FormulaC33H47N5O8S
Molecular Weight673.82000
Purity98.00
Boiling Point848.7ºC at 760 mmHg
SMILESCC(C)CC1C(=O)N2CCCC2C2(O)OC(NC(=O)C3CC4c5cccc6[nH]cc(c56)CC4N(C)C3)(C(C)C)C(=O)N12.CS(=O)(=O)O
InChIInChI=1S/C32H43N5O5.CH4O3S/c1-17(2)12-25-29(39)36-11-7-10-26(36)32(41)37(25)30(40)31(42-32,18(3)4)34-28(38)20-13-22-21-8-6-9-23-27(21)19(15-33-23)14-24(22)35(5)16-20;1-5(2,3)4/h6,8-9,15,17-18,20,22,24-26,33,41H,7,10-14,16H2,1-5H3,(H,34,38);1H3,(H,2,3,4)/t20-,22-,24-,25+,26+,31-,32+;/m1./s1
InChI KeyTZGKQIBPZOZAKF-PJLVGBPESA-N
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