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Details

Stereochemistry ABSOLUTE
Molecular Formula C22H27N2O3.I
Molecular Weight 494.3659
Optical Activity UNSPECIFIED
Defined Stereocenters 5 / 5
E/Z Centers 1
Charge 0

SHOW SMILES / InChI
Structure of MACUSINE A IODIDE

SMILES

[I-].COC(=O)[C@]1(CO)[C@H]2C[C@H]3C4=C(C[C@@H]1[N@@+]3(C)C\C2=C\C)C5=C(N4)C=CC=C5

InChI

InChIKey=VVOSRYHOWNMDIG-PVFPYHDPSA-M
InChI=1S/C22H27N2O3.HI/c1-4-13-11-24(2)18-10-16(13)22(12-25,21(26)27-3)19(24)9-15-14-7-5-6-8-17(14)23-20(15)18;/h4-8,16,18-19,23,25H,9-12H2,1-3H3;1H/q+1;/p-1/b13-4-;/t16-,18-,19-,22+,24-;/m0./s1

HIDE SMILES / InChI

Approval Year

Name Type Language
MACUSINE A IODIDE
Common Name English
16-EPIMACUSINE C IODIDE
Preferred Name English
N-METHYLPOLYNEURIDINIUM IODIDE
Common Name English
SARPAGANIUM, 17-HYDROXY-16-(METHOXYCARBONYL)-4-METHYL-, IODIDE (1:1), (16R)-
Systematic Name English
SARPAGANIUM, 17-HYDROXY-16-(METHOXYCARBONYL)-4-METHYL-, IODIDE, (16R)-
Systematic Name English
Code System Code Type Description
PUBCHEM
91617841
Created by admin on Mon Mar 31 20:39:06 GMT 2025 , Edited by admin on Mon Mar 31 20:39:06 GMT 2025
PRIMARY
FDA UNII
964B970QGG
Created by admin on Mon Mar 31 20:39:06 GMT 2025 , Edited by admin on Mon Mar 31 20:39:06 GMT 2025
PRIMARY
CAS
58462-33-2
Created by admin on Mon Mar 31 20:39:06 GMT 2025 , Edited by admin on Mon Mar 31 20:39:06 GMT 2025
PRIMARY