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Details

Stereochemistry ABSOLUTE
Molecular Formula C32H40BrN5O5.CH4O3S
Molecular Weight 750.7
Optical Activity UNSPECIFIED
Defined Stereocenters 6 / 6
E/Z Centers 0
Charge 0

SHOW SMILES / InChI
Structure of BROMOCRIPTINE MESYLATE

SMILES

CS(O)(=O)=O.[H][C@@]12CCCN1C(=O)[C@H](CC(C)C)N3C(=O)[C@](NC(=O)[C@H]4CN(C)[C@]5([H])CC6=C(Br)NC7=C6C(=CC=C7)C5=C4)(O[C@@]23O)C(C)C

InChI

InChIKey=NOJMTMIRQRDZMT-GSPXQYRGSA-N
InChI=1S/C32H40BrN5O5.CH4O3S/c1-16(2)12-24-29(40)37-11-7-10-25(37)32(42)38(24)30(41)31(43-32,17(3)4)35-28(39)18-13-20-19-8-6-9-22-26(19)21(27(33)34-22)14-23(20)36(5)15-18;1-5(2,3)4/h6,8-9,13,16-18,23-25,34,42H,7,10-12,14-15H2,1-5H3,(H,35,39);1H3,(H,2,3,4)/t18-,23-,24+,25+,31-,32+;/m1./s1

HIDE SMILES / InChI
Molecular Formula CH4O3S
Molecular Weight 96.106
Charge 0
Count
Stereochemistry ACHIRAL
Additional Stereochemistry No
Defined Stereocenters 0 / 0
E/Z Centers 0
Optical Activity NONE
Molecular Formula C32H40BrN5O5
Molecular Weight 654.594
Charge 0
Count
Stereochemistry ABSOLUTE
Additional Stereochemistry No
Defined Stereocenters 6 / 6
E/Z Centers 0
Optical Activity UNSPECIFIED

Approval Year

Unknown
86413
Substance Class Chemical
Created
by admin
on Fri Dec 15 15:10:46 UTC 2023
Edited
by admin
on Fri Dec 15 15:10:46 UTC 2023
Record UNII
FFP983J3OD
Record Status Validated (UNII)
Record Version
  • Download
Name Type Language
BROMOCRIPTINE MESYLATE
ORANGE BOOK   USAN   USP   USP-RS   VANDF  
USAN  
Official Name English
BROMOCRIPTINE MESILATE [JAN]
Common Name English
BROMOCRIPTINE METHANESULFONATE [MI]
Common Name English
BROMOCRIPTINE METHANESULFONATE
MI  
Common Name English
PARLODEL
Brand Name English
BROMOCRIPTINE MESYLATE [VANDF]
Common Name English
Bromocriptine mesilate [WHO-DD]
Common Name English
BROMOCRIPTINE MESILATE [EP MONOGRAPH]
Common Name English
BROMOCRIPTINE MESYLATE [USP MONOGRAPH]
Common Name English
BROMOCRIPTINE MESYLATE [USAN]
Common Name English
2-BROMOERGOCRYPTINE MONOMETHANESULPHONATE (SALT)
Common Name English
ERGOTAMAN-3',6',18-TRIONE, 2-BROMO-12'-HYDROXY-2'-(1-METHYLETHYL)-5'-(2-METHYLPROPYL)-, MONOMETHANESULFONATE (SALT), (5'.ALPHA.)-
Common Name English
BROMOCRIPTINE MESILATE
EP   MART.   WHO-DD  
Common Name English
CB-154 MESILATE
Common Name English
CYCLOSET
Brand Name English
2-BROMOERGOCRYPTINE MESYLATE
Common Name English
2-Bromoergocryptine monomethanesulfonate (salt)
Common Name English
CB-154
Code English
BROMOCRIPTINE MESYLATE [USP-RS]
Common Name English
CB-154 MESYLATE
Code English
NSC-755915
Code English
ERGOTAMAN-3',6',18-TRIONE, 2-BROMO-12'-HYDROXY-2'-(1-METHYLETHYL)-5'-(2-METHYLPROPYL)-, MONOMETHANESULPHONATE (SALT), (5'.ALPHA.)-
Common Name English
BROMOCRIPTINE MESYLATE [ORANGE BOOK]
Common Name English
BROMOCRIPTINE MESILATE [MART.]
Common Name English
Classification Tree Code System Code
NCI_THESAURUS C66884
Created by admin on Fri Dec 15 15:10:46 UTC 2023 , Edited by admin on Fri Dec 15 15:10:46 UTC 2023
NCI_THESAURUS C1509
Created by admin on Fri Dec 15 15:10:46 UTC 2023 , Edited by admin on Fri Dec 15 15:10:46 UTC 2023
Code System Code Type Description
SMS_ID
100000090410
Created by admin on Fri Dec 15 15:10:46 UTC 2023 , Edited by admin on Fri Dec 15 15:10:46 UTC 2023
PRIMARY
ECHA (EC/EINECS)
244-881-1
Created by admin on Fri Dec 15 15:10:46 UTC 2023 , Edited by admin on Fri Dec 15 15:10:46 UTC 2023
PRIMARY
PUBCHEM
31100
Created by admin on Fri Dec 15 15:10:46 UTC 2023 , Edited by admin on Fri Dec 15 15:10:46 UTC 2023
PRIMARY
ChEMBL
CHEMBL493
Created by admin on Fri Dec 15 15:10:46 UTC 2023 , Edited by admin on Fri Dec 15 15:10:46 UTC 2023
PRIMARY
CHEBI
3182
Created by admin on Fri Dec 15 15:10:46 UTC 2023 , Edited by admin on Fri Dec 15 15:10:46 UTC 2023
PRIMARY
EVMPD
SUB00878MIG
Created by admin on Fri Dec 15 15:10:46 UTC 2023 , Edited by admin on Fri Dec 15 15:10:46 UTC 2023
PRIMARY
EPA CompTox
DTXSID6020197
Created by admin on Fri Dec 15 15:10:46 UTC 2023 , Edited by admin on Fri Dec 15 15:10:46 UTC 2023
PRIMARY
NSC
755915
Created by admin on Fri Dec 15 15:10:46 UTC 2023 , Edited by admin on Fri Dec 15 15:10:46 UTC 2023
PRIMARY
DAILYMED
FFP983J3OD
Created by admin on Fri Dec 15 15:10:46 UTC 2023 , Edited by admin on Fri Dec 15 15:10:46 UTC 2023
PRIMARY
CAS
22260-51-1
Created by admin on Fri Dec 15 15:10:46 UTC 2023 , Edited by admin on Fri Dec 15 15:10:46 UTC 2023
PRIMARY
MERCK INDEX
m2694
Created by admin on Fri Dec 15 15:10:46 UTC 2023 , Edited by admin on Fri Dec 15 15:10:46 UTC 2023
PRIMARY Merck Index
DRUG BANK
DBSALT001209
Created by admin on Fri Dec 15 15:10:46 UTC 2023 , Edited by admin on Fri Dec 15 15:10:46 UTC 2023
PRIMARY
NCI_THESAURUS
C317
Created by admin on Fri Dec 15 15:10:46 UTC 2023 , Edited by admin on Fri Dec 15 15:10:46 UTC 2023
PRIMARY
RXCUI
142426
Created by admin on Fri Dec 15 15:10:46 UTC 2023 , Edited by admin on Fri Dec 15 15:10:46 UTC 2023
PRIMARY RxNorm
FDA UNII
FFP983J3OD
Created by admin on Fri Dec 15 15:10:46 UTC 2023 , Edited by admin on Fri Dec 15 15:10:46 UTC 2023
PRIMARY
RS_ITEM_NUM
1076501
Created by admin on Fri Dec 15 15:10:46 UTC 2023 , Edited by admin on Fri Dec 15 15:10:46 UTC 2023
PRIMARY
Related Record Type Details
Structure of BROMOCRIPTINE
PARENT -> SALT/SOLVATE
Related Record Type Details
Structure of BROMOCRIPTINE
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