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Details

Stereochemistry ABSOLUTE
Molecular Formula C22H26N2O3.ClH
Molecular Weight 402.914
Optical Activity UNSPECIFIED
Defined Stereocenters 3 / 3
E/Z Centers 1
Charge 0

SHOW SMILES / InChI
Structure of CORYNANTHEINE HYDROCHLORIDE

SMILES

Cl.[H][C@@]12C[C@@H]([C@H](CN1CCC3=C2NC4=CC=CC=C34)C=C)C(=C/OC)\C(=O)OC

InChI

InChIKey=LHDAPOGMZVLZPY-PTRHOHCYSA-N
InChI=1S/C22H26N2O3.ClH/c1-4-14-12-24-10-9-16-15-7-5-6-8-19(15)23-21(16)20(24)11-17(14)18(13-26-2)22(25)27-3;/h4-8,13-14,17,20,23H,1,9-12H2,2-3H3;1H/b18-13+;/t14-,17-,20-;/m0./s1

HIDE SMILES / InChI

Molecular Formula C22H26N2O3
Molecular Weight 366.4534
Charge 0
Count
Stereochemistry ABSOLUTE
Additional Stereochemistry No
Defined Stereocenters 3 / 3
E/Z Centers 1
Optical Activity UNSPECIFIED

Molecular Formula ClH
Molecular Weight 36.461
Charge 0
Count
Stereochemistry ACHIRAL
Additional Stereochemistry No
Defined Stereocenters 0 / 0
E/Z Centers 0
Optical Activity NONE

Approval Year

PubMed

PubMed

TitleDatePubMed
Evaluation of natural products as inhibitors of human immunodeficiency virus type 1 (HIV-1) reverse transcriptase.
1991 Jan-Feb
Substance Class Chemical
Created
by admin
on Sat Dec 16 07:57:00 GMT 2023
Edited
by admin
on Sat Dec 16 07:57:00 GMT 2023
Record UNII
E78X9R5H9L
Record Status Validated (UNII)
Record Version
  • Download
Name Type Language
CORYNANTHEINE HYDROCHLORIDE
MI  
Common Name English
(.ALPHA.E,2S,3R,12BS)-3-ETHENYL-1,2,3,4,6,7,12,12B-OCTAHYDRO-.ALPHA.-(METHOXYMETHYLENE)INDOLO(2,3-A)QUINOLIZINE-2-ACETIC ACID METHYL ESTER, HYDROCHLORIDE
Systematic Name English
CORYNANTHEINE HYDROCHLORIDE, (+)-
Common Name English
INDOLO(2,3-A)QUINOLIZINE-2-ACETIC ACID, 3-ETHENYL-1,2,3,4,6,7,12,12B-OCTAHYDRO-.ALPHA.-(METHOXYMETHYLENE)-, METHYL ESTER, MONOHYDROCHLORIDE, (.ALPHA.E,2S,3R,12BS)-
Systematic Name English
CORYNANTHEINE HYDROCHLORIDE [MI]
Common Name English
Code System Code Type Description
CAS
5986-06-1
Created by admin on Sat Dec 16 07:57:00 GMT 2023 , Edited by admin on Sat Dec 16 07:57:00 GMT 2023
PRIMARY
FDA UNII
E78X9R5H9L
Created by admin on Sat Dec 16 07:57:00 GMT 2023 , Edited by admin on Sat Dec 16 07:57:00 GMT 2023
PRIMARY
PUBCHEM
3037996
Created by admin on Sat Dec 16 07:57:00 GMT 2023 , Edited by admin on Sat Dec 16 07:57:00 GMT 2023
PRIMARY
MERCK INDEX
m3804
Created by admin on Sat Dec 16 07:57:00 GMT 2023 , Edited by admin on Sat Dec 16 07:57:00 GMT 2023
PRIMARY Merck Index