U.S. Department of Health & Human Services Divider Arrow National Institutes of Health Divider Arrow NCATS

Details

Stereochemistry ABSOLUTE
Molecular Formula C19H23N3O2.H3O4P
Molecular Weight 423.4
Optical Activity UNSPECIFIED
Defined Stereocenters 3 / 3
E/Z Centers 0
Charge 0

SHOW SMILES / InChI
Structure of ERGONOVINE PHOSPHATE

SMILES

OP(O)(O)=O.[H][C@@]12CC3=CNC4=C3C(=CC=C4)C1=C[C@H](CN2C)C(=O)N[C@@H](C)CO

InChI

InChIKey=HWXVIFBWWAVTDP-VSDOXBCFSA-N
InChI=1S/C19H23N3O2.H3O4P/c1-11(10-23)21-19(24)13-6-15-14-4-3-5-16-18(14)12(8-20-16)7-17(15)22(2)9-13;1-5(2,3)4/h3-6,8,11,13,17,20,23H,7,9-10H2,1-2H3,(H,21,24);(H3,1,2,3,4)/t11-,13+,17+;/m0./s1

HIDE SMILES / InChI

Molecular Formula C19H23N3O2
Molecular Weight 325.4048
Charge 0
Count
Stereochemistry ABSOLUTE
Additional Stereochemistry No
Defined Stereocenters 3 / 3
E/Z Centers 0
Optical Activity UNSPECIFIED

Molecular Formula H3O4P
Molecular Weight 97.9952
Charge 0
Count
Stereochemistry ACHIRAL
Additional Stereochemistry No
Defined Stereocenters 0 / 0
E/Z Centers 0
Optical Activity NONE

Approval Year

Substance Class Chemical
Created
by admin
on Sat Dec 16 08:07:38 GMT 2023
Edited
by admin
on Sat Dec 16 08:07:38 GMT 2023
Record UNII
V73TZQ46GD
Record Status Validated (UNII)
Record Version
  • Download
Name Type Language
ERGONOVINE PHOSPHATE
Common Name English
Ergometrine phosphate [WHO-DD]
Common Name English
ERGOMETRINE PHOSPHATE
WHO-DD  
Common Name English
9,10-DIDEHYDRO-N-((S)-2-HYDROXY-1-METHYLETHYL)-6-METHYLERGOLINE-8.BETA.-CARBOXAMIDE MONOPHOSPHATE
Systematic Name English
Code System Code Type Description
FDA UNII
V73TZQ46GD
Created by admin on Sat Dec 16 08:07:38 GMT 2023 , Edited by admin on Sat Dec 16 08:07:38 GMT 2023
PRIMARY
PUBCHEM
76957550
Created by admin on Sat Dec 16 08:07:38 GMT 2023 , Edited by admin on Sat Dec 16 08:07:38 GMT 2023
PRIMARY
SMS_ID
100000087268
Created by admin on Sat Dec 16 08:07:38 GMT 2023 , Edited by admin on Sat Dec 16 08:07:38 GMT 2023
PRIMARY
EVMPD
SUB01932MIG
Created by admin on Sat Dec 16 08:07:38 GMT 2023 , Edited by admin on Sat Dec 16 08:07:38 GMT 2023
PRIMARY