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Details

Stereochemistry ABSOLUTE
Molecular Formula C27H34N2O9.ClH
Molecular Weight 567.028
Optical Activity ( - )
Defined Stereocenters 9 / 9
E/Z Centers 0
Charge 0

SHOW SMILES / InChI
Structure of Strictosidine hydrochloride

SMILES

Cl.COC(=O)C1=CO[C@@H](O[C@@H]2O[C@H](CO)[C@@H](O)[C@H](O)[C@H]2O)[C@H](C=C)[C@@H]1C[C@@H]3NCCC4=C3NC5=C4C=CC=C5

InChI

InChIKey=WXZRVHWQLXPXKD-KRYHCBEISA-N
InChI=1S/C27H34N2O9.ClH/c1-3-13-16(10-19-21-15(8-9-28-19)14-6-4-5-7-18(14)29-21)17(25(34)35-2)12-36-26(13)38-27-24(33)23(32)22(31)20(11-30)37-27;/h3-7,12-13,16,19-20,22-24,26-33H,1,8-11H2,2H3;1H/t13-,16+,19+,20-,22-,23+,24-,26+,27+;/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 C27H34N2O9
Molecular Weight 530.5669
Charge 0
Count
Stereochemistry ABSOLUTE
Additional Stereochemistry No
Defined Stereocenters 9 / 9
E/Z Centers 0
Optical Activity UNSPECIFIED

Approval Year

Substance Class Chemical
Created
by admin
on Wed Apr 02 16:50:07 GMT 2025
Edited
by admin
on Wed Apr 02 16:50:07 GMT 2025
Record UNII
C2YXD79CJX
Record Status Validated (UNII)
Record Version
  • Download
Name Type Language
3-Isovincoside hydrochloride
Preferred Name English
Strictosidine hydrochloride
Common Name English
2H-Pyran-5-carboxylic acid, 3-ethenyl-2-(?-D-glucopyranosyloxy)-3,4-dihydro-4-[[(1S)-2,3,4,9-tetrahydro-1H-pyrido[3,4-b]indol-1-yl]methyl]-, methyl ester, monohydrochloride, (2S,3R,4S)-
Systematic Name English
Isovincoside monohydrochloride
Common Name English
2H-Pyran-5-carboxylic acid, 3-ethenyl-2-(?-D-glucopyranosyloxy)-3,4-dihydro-4-[[(1S)-2,3,4,9-tetrahydro-1H-pyrido[3,4-b]indol-1-yl]methyl]-, methyl ester, hydrochloride (1:1), (2S,3R,4S)-
Systematic Name English
Isovincoside hydrochloride
Common Name English
Code System Code Type Description
CAS
71392-26-2
Created by admin on Wed Apr 02 16:50:07 GMT 2025 , Edited by admin on Wed Apr 02 16:50:07 GMT 2025
PRIMARY
PUBCHEM
166177308
Created by admin on Wed Apr 02 16:50:07 GMT 2025 , Edited by admin on Wed Apr 02 16:50:07 GMT 2025
PRIMARY
FDA UNII
C2YXD79CJX
Created by admin on Wed Apr 02 16:50:07 GMT 2025 , Edited by admin on Wed Apr 02 16:50:07 GMT 2025
PRIMARY
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