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

Details

Stereochemistry ABSOLUTE
Molecular Formula C16H27NO5
Molecular Weight 313.3893
Optical Activity UNSPECIFIED
Defined Stereocenters 4 / 4
E/Z Centers 0
Charge 0

SHOW SMILES / InChI
Structure of SINCAMIDINE

SMILES

CO[C@H](C)[C@@](O)(C(C)C)C(=O)OCC1=CCN2CC[C@@H](O)[C@@H]12

InChI

InChIKey=LMFKRLGHEKVMNT-MEWXFMAXSA-N
InChI=1S/C16H27NO5/c1-10(2)16(20,11(3)21-4)15(19)22-9-12-5-7-17-8-6-13(18)14(12)17/h5,10-11,13-14,18,20H,6-9H2,1-4H3/t11-,13-,14-,16+/m1/s1

HIDE SMILES / InChI

Molecular Formula C16H27NO5
Molecular Weight 313.3893
Charge 0
Count
Stereochemistry ABSOLUTE
Additional Stereochemistry No
Defined Stereocenters 4 / 4
E/Z Centers 0
Optical Activity UNSPECIFIED

Approval Year

Substance Class Chemical
Created
by admin
on Mon Mar 31 23:16:39 GMT 2025
Edited
by admin
on Mon Mar 31 23:16:39 GMT 2025
Record UNII
X7KRY4YZV9
Record Status Validated (UNII)
Record Version
  • Download
Name Type Language
SINCAMIDINE
Common Name English
NSC-30620
Preferred Name English
7R-HELIOTRINE
Common Name English
BUTANOIC ACID, 2-HYDROXY-2-((1R)-1-METHOXYETHYL)-3-METHYL-, ((1R,7AR)-2,3,5,7A-TETRAHYDRO-1-HYDROXY-1H-PYRROLIZIN-7-YL)METHYL ESTER, (2S)-
Systematic Name English
EPIHELIOTRINE
Common Name English
1-EPIHELIOTRINE
Common Name English
BUTANOIC ACID, 2-HYDROXY-2-(1-METHOXYETHYL)-3-METHYL-, (2,3,5,7A-TETRAHYDRO-1-HYDROXY-1H-PYRROLIZIN-7-YL)METHYL ESTER, (1R-(1.ALPHA.,7(S*(R*)),7A.BETA.))-
Systematic Name English
Code System Code Type Description
CAS
10594-35-1
Created by admin on Mon Mar 31 23:16:39 GMT 2025 , Edited by admin on Mon Mar 31 23:16:39 GMT 2025
SUPERSEDED
NSC
30620
Created by admin on Mon Mar 31 23:16:39 GMT 2025 , Edited by admin on Mon Mar 31 23:16:39 GMT 2025
PRIMARY
FDA UNII
X7KRY4YZV9
Created by admin on Mon Mar 31 23:16:39 GMT 2025 , Edited by admin on Mon Mar 31 23:16:39 GMT 2025
PRIMARY
EPA CompTox
DTXSID30417920
Created by admin on Mon Mar 31 23:16:39 GMT 2025 , Edited by admin on Mon Mar 31 23:16:39 GMT 2025
PRIMARY
CAS
126784-33-6
Created by admin on Mon Mar 31 23:16:39 GMT 2025 , Edited by admin on Mon Mar 31 23:16:39 GMT 2025
SUPERSEDED
PUBCHEM
11861112
Created by admin on Mon Mar 31 23:16:39 GMT 2025 , Edited by admin on Mon Mar 31 23:16:39 GMT 2025
PRIMARY
CAS
59532-50-2
Created by admin on Mon Mar 31 23:16:39 GMT 2025 , Edited by admin on Mon Mar 31 23:16:39 GMT 2025
PRIMARY