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

Details

Stereochemistry ABSOLUTE
Molecular Formula C30H51N2O3
Molecular Weight 487.7375
Optical Activity UNSPECIFIED
Defined Stereocenters 10 / 11
E/Z Centers 0
Charge 1

SHOW SMILES / InChI
Structure of DESACETYLROCURONIUM

SMILES

C[C@]12CC[C@H]3[C@@H](CC[C@H]4C[C@H](O)[C@H](C[C@]34C)N5CCOCC5)[C@@H]1C[C@@H]([C@@H]2O)[N+]6(CC=C)CCCC6

InChI

InChIKey=IHSGDUHUXOPCHC-GUGJMVMRSA-N
InChI=1S/C30H51N2O3/c1-4-13-32(14-5-6-15-32)26-19-24-22-8-7-21-18-27(33)25(31-11-16-35-17-12-31)20-30(21,3)23(22)9-10-29(24,2)28(26)34/h4,21-28,33-34H,1,5-20H2,2-3H3/q+1/t21-,22+,23-,24-,25-,26-,27-,28-,29-,30-/m0/s1

HIDE SMILES / InChI

Approval Year

Name Type Language
DESACETYLROCURONIUM ION
Preferred Name English
DESACETYLROCURONIUM
Common Name English
DESACETYLROCURONIUM CATION
Common Name English
ROCURONIUM BROMIDE IMPURITY C [EP IMPURITY]
Common Name English
PYRROLIDINIUM, 1-((2.BETA.,3.ALPHA.,5.ALPHA.,16.BETA.,17.BETA.)-3,17-DIHYDROXY-2-(4-MORPHOLINYL)ANDROSTAN-16-YL)-1-(2-PROPENYL)-
Systematic Name English
Code System Code Type Description
PUBCHEM
182557
Created by admin on Mon Mar 31 18:09:02 GMT 2025 , Edited by admin on Mon Mar 31 18:09:02 GMT 2025
PRIMARY
FDA UNII
V79VN3HWQZ
Created by admin on Mon Mar 31 18:09:02 GMT 2025 , Edited by admin on Mon Mar 31 18:09:02 GMT 2025
PRIMARY
CAS
738548-78-2
Created by admin on Mon Mar 31 18:09:02 GMT 2025 , Edited by admin on Mon Mar 31 18:09:02 GMT 2025
PRIMARY