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Details

Stereochemistry ABSOLUTE
Molecular Formula C32H38N2O8.ClH
Molecular Weight 615.114
Optical Activity UNSPECIFIED
Defined Stereocenters 6 / 6
E/Z Centers 0
Charge 0

SHOW SMILES / InChI
Structure of DESERPIDINE HYDROCHLORIDE

SMILES

Cl.[H][C@]12C[C@@H](OC(=O)C3=CC(OC)=C(OC)C(OC)=C3)[C@H](OC)[C@@H](C(=O)OC)[C@@]1([H])C[C@@]4([H])N(CCC5=C4NC6=C5C=CC=C6)C2

InChI

InChIKey=YCNOGQOHKRDAHJ-UZXCFUCJSA-N
InChI=1S/C32H38N2O8.ClH/c1-37-24-12-17(13-25(38-2)29(24)39-3)31(35)42-26-14-18-16-34-11-10-20-19-8-6-7-9-22(19)33-28(20)23(34)15-21(18)27(30(26)40-4)32(36)41-5;/h6-9,12-13,18,21,23,26-27,30,33H,10-11,14-16H2,1-5H3;1H/t18-,21+,23-,26-,27+,30+;/m1./s1

HIDE SMILES / InChI

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

Molecular Formula C32H38N2O8
Molecular Weight 578.6527
Charge 0
Count
Stereochemistry ABSOLUTE
Additional Stereochemistry No
Defined Stereocenters 6 / 6
E/Z Centers 0
Optical Activity UNSPECIFIED

Approval Year

Substance Class Chemical
Created
by admin
on Sat Dec 16 10:06:41 UTC 2023
Edited
by admin
on Sat Dec 16 10:06:41 UTC 2023
Record UNII
6LPC48045D
Record Status Validated (UNII)
Record Version
  • Download
Name Type Language
DESERPIDINE HYDROCHLORIDE
MI  
Common Name English
CANESCINE HYDROCHLORIDE
Common Name English
YOHIMBAN-16-CARBOXYLIC ACID, 17-METHOXY-18-((3,4,5-TRIMETHOXYBENZOYL)OXY)-, METHYL ESTER, MONOHYDROCHLORIDE, (3.BETA.,16.BETA.,17.ALPHA.,18.BETA.,20.ALPHA.)-
Systematic Name English
DESERPIDINE HYDROCHLORIDE, (-)-
Common Name English
DESERPIDINE HYDROCHLORIDE [MI]
Common Name English
Code System Code Type Description
PUBCHEM
73425400
Created by admin on Sat Dec 16 10:06:41 UTC 2023 , Edited by admin on Sat Dec 16 10:06:41 UTC 2023
PRIMARY
CAS
6033-69-8
Created by admin on Sat Dec 16 10:06:41 UTC 2023 , Edited by admin on Sat Dec 16 10:06:41 UTC 2023
PRIMARY
DRUG BANK
DBSALT002253
Created by admin on Sat Dec 16 10:06:41 UTC 2023 , Edited by admin on Sat Dec 16 10:06:41 UTC 2023
PRIMARY
EPA CompTox
DTXSID10387112
Created by admin on Sat Dec 16 10:06:41 UTC 2023 , Edited by admin on Sat Dec 16 10:06:41 UTC 2023
PRIMARY
FDA UNII
6LPC48045D
Created by admin on Sat Dec 16 10:06:41 UTC 2023 , Edited by admin on Sat Dec 16 10:06:41 UTC 2023
PRIMARY
MERCK INDEX
m4189
Created by admin on Sat Dec 16 10:06:41 UTC 2023 , Edited by admin on Sat Dec 16 10:06:41 UTC 2023
PRIMARY Merck Index
Related Record Type Details
ACTIVE MOIETY