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Details

Stereochemistry ABSOLUTE
Molecular Formula C17H18O5
Molecular Weight 302.3218
Optical Activity ( + )
Defined Stereocenters 1 / 1
E/Z Centers 0
Charge 0

SHOW SMILES / InChI
Structure of Isomucronulatol, (+)-

SMILES

COC1=C(OC)C(O)=C(C=C1)[C@H]2COC3=C(C2)C=CC(O)=C3

InChI

InChIKey=NQRBAPDEZYMKFL-LLVKDONJSA-N
InChI=1S/C17H18O5/c1-20-14-6-5-13(16(19)17(14)21-2)11-7-10-3-4-12(18)8-15(10)22-9-11/h3-6,8,11,18-19H,7,9H2,1-2H3/t11-/m1/s1

HIDE SMILES / InChI

Molecular Formula C17H18O5
Molecular Weight 302.3218
Charge 0
Count
Stereochemistry ABSOLUTE
Additional Stereochemistry No
Defined Stereocenters 1 / 1
E/Z Centers 0
Optical Activity UNSPECIFIED

Approval Year

Substance Class Chemical
Created
by admin
on Wed Apr 02 19:15:19 GMT 2025
Edited
by admin
on Wed Apr 02 19:15:19 GMT 2025
Record UNII
83SS6EWJ82
Record Status Validated (UNII)
Record Version
  • Download
Name Type Language
Isomucronulatol, (+)-
Common Name English
(+)-Isomucronulatol
Preferred Name English
(3S)-3,4-Dihydro-3-(2-hydroxy-3,4-dimethoxyphenyl)-2H-1-benzopyran-7-ol
Systematic Name English
2H-1-Benzopyran-7-ol, 3,4-dihydro-3-(2-hydroxy-3,4-dimethoxyphenyl)-, (3S)-
Systematic Name English
Code System Code Type Description
PUBCHEM
51536463
Created by admin on Wed Apr 02 19:15:19 GMT 2025 , Edited by admin on Wed Apr 02 19:15:19 GMT 2025
PRIMARY
CAS
450415-94-8
Created by admin on Wed Apr 02 19:15:19 GMT 2025 , Edited by admin on Wed Apr 02 19:15:19 GMT 2025
PRIMARY
FDA UNII
83SS6EWJ82
Created by admin on Wed Apr 02 19:15:19 GMT 2025 , Edited by admin on Wed Apr 02 19:15:19 GMT 2025
PRIMARY
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