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Details

Stereochemistry UNKNOWN
Molecular Formula C47H67N3O7
Molecular Weight 786.0508
Optical Activity UNSPECIFIED
Defined Stereocenters 0 / 3
E/Z Centers 0
Charge 0

SHOW SMILES / InChI
Structure of PILOCEREINE ACETATE

SMILES

COC1=C(OC2=C3C(CC(C)C)N(C)CCC3=CC(OC)=C2OC4=C5C(CC(C)C)N(C)CCC5=CC(OC)=C4OC(C)=O)C=C6C(CC(C)C)N(C)CCC6=C1

InChI

InChIKey=WYDYPQXNIUIEJZ-UHFFFAOYSA-N
InChI=1S/C47H67N3O7/c1-27(2)20-35-34-26-39(38(52-11)23-31(34)14-17-48(35)8)56-46-42-32(15-18-49(9)36(42)21-28(3)4)25-41(54-13)45(46)57-47-43-33(16-19-50(10)37(43)22-29(5)6)24-40(53-12)44(47)55-30(7)51/h23-29,35-37H,14-22H2,1-13H3

HIDE SMILES / InChI

Molecular Formula C47H67N3O7
Molecular Weight 786.0508
Charge 0
Count
Stereochemistry MIXED
Additional Stereochemistry No
Defined Stereocenters 0 / 3
E/Z Centers 0
Optical Activity UNSPECIFIED

Approval Year

Substance Class Chemical
Created
by admin
on Sat Dec 16 09:32:18 GMT 2023
Edited
by admin
on Sat Dec 16 09:32:18 GMT 2023
Record UNII
GG7566GH1I
Record Status Validated (UNII)
Record Version
  • Download
Name Type Language
PILOCEREINE ACETATE
MI  
Common Name English
PILOCEREINE, ACETATE
Common Name English
7-ISOQUINOLINOL, 1,2,3,4-TETRAHYDRO-6-METHOXY-2-METHYL-1-(2-METHYLPROPYL)-8-((1,2,3,4-TETRAHYDRO-6-METHOXY-2-METHYL-1-(2-METHYLPROPYL)-8-((1,2,3,4-TETRAHYDRO-6-METHOXY-2-METHYL-1-(2-METHYLPROPYL)-7-ISOQUINOLINYL)OXY)-7-ISOQUINOLINYL)OXY)-, 7-ACETATE
Systematic Name English
PILOCEREINE ACETATE [MI]
Common Name English
Code System Code Type Description
PUBCHEM
91667798
Created by admin on Sat Dec 16 09:32:18 GMT 2023 , Edited by admin on Sat Dec 16 09:32:18 GMT 2023
PRIMARY
FDA UNII
GG7566GH1I
Created by admin on Sat Dec 16 09:32:18 GMT 2023 , Edited by admin on Sat Dec 16 09:32:18 GMT 2023
PRIMARY
MERCK INDEX
m892
Created by admin on Sat Dec 16 09:32:18 GMT 2023 , Edited by admin on Sat Dec 16 09:32:18 GMT 2023
PRIMARY Merck Index
CAS
106570-48-3
Created by admin on Sat Dec 16 09:32:18 GMT 2023 , Edited by admin on Sat Dec 16 09:32:18 GMT 2023
PRIMARY