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

Details

Stereochemistry ABSOLUTE
Molecular Formula C27H45NO3
Molecular Weight 431.6511
Optical Activity UNSPECIFIED
Defined Stereocenters 13 / 13
E/Z Centers 0
Charge 0

SHOW SMILES / InChI
Structure of ISOVERTICINE

SMILES

C[C@H]1CC[C@@H]2N(C1)C[C@H]3[C@@H]4C[C@H]5[C@@H](C[C@@H](O)[C@H]6C[C@@H](O)CC[C@]56C)[C@@H]4CC[C@@H]3[C@]2(C)O

InChI

InChIKey=IUKLSMSEHKDIIP-RZNVUHDWSA-N
InChI=1S/C27H45NO3/c1-15-4-7-25-27(3,31)21-6-5-17-18(20(21)14-28(25)13-15)11-22-19(17)12-24(30)23-10-16(29)8-9-26(22,23)2/h15-25,29-31H,4-14H2,1-3H3/t15-,16-,17+,18+,19-,20-,21-,22-,23+,24+,25-,26+,27-/m0/s1

HIDE SMILES / InChI

Molecular Formula C27H45NO3
Molecular Weight 431.6511
Charge 0
Count
Stereochemistry ABSOLUTE
Additional Stereochemistry No
Defined Stereocenters 13 / 13
E/Z Centers 0
Optical Activity UNSPECIFIED

Approval Year

Substance Class Chemical
Created
by admin
on Mon Mar 31 23:34:26 GMT 2025
Edited
by admin
on Mon Mar 31 23:34:26 GMT 2025
Record UNII
8EYY30F96F
Record Status Validated (UNII)
Record Version
  • Download
Name Type Language
17-EPIDIHYDROIMPERIALINE
Preferred Name English
ISOVERTICINE
Common Name English
6.BETA.-DIHYDROVERTICINONE
Common Name English
ISOPEIMINE
Common Name English
6-EPIVERTICINE
Common Name English
CEVANE-3,6,20-TRIOL, (3.BETA.,5.ALPHA.,6.BETA.)-
Systematic Name English
Code System Code Type Description
FDA UNII
8EYY30F96F
Created by admin on Mon Mar 31 23:34:26 GMT 2025 , Edited by admin on Mon Mar 31 23:34:26 GMT 2025
PRIMARY
EPA CompTox
DTXSID301317817
Created by admin on Mon Mar 31 23:34:26 GMT 2025 , Edited by admin on Mon Mar 31 23:34:26 GMT 2025
PRIMARY
PUBCHEM
21573744
Created by admin on Mon Mar 31 23:34:26 GMT 2025 , Edited by admin on Mon Mar 31 23:34:26 GMT 2025
PRIMARY
CAS
23496-43-7
Created by admin on Mon Mar 31 23:34:26 GMT 2025 , Edited by admin on Mon Mar 31 23:34:26 GMT 2025
PRIMARY