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Details

Stereochemistry ABSOLUTE
Molecular Formula C17H18O4
Molecular Weight 286.3224
Optical Activity ( + )
Defined Stereocenters 1 / 1
E/Z Centers 0
Charge 0

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

SMILES

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

InChI

InChIKey=FWAWTPASGRNXTO-GFCCVEGCSA-N
InChI=1S/C17H18O4/c1-19-13-5-6-15(16(18)8-13)12-7-11-3-4-14(20-2)9-17(11)21-10-12/h3-6,8-9,12,18H,7,10H2,1-2H3/t12-/m1/s1

HIDE SMILES / InChI

Molecular Formula C17H18O4
Molecular Weight 286.3224
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 21:09:55 GMT 2025
Edited
by admin
on Wed Apr 02 21:09:55 GMT 2025
Record UNII
4H3VM57U2D
Record Status Validated (UNII)
Record Version
  • Download
Name Type Language
Isosativan, (+)-
Common Name English
(3S)-2?-Hydroxy-7,4?-dimethoxyisoflavan
Preferred Name English
(3s)-2?-Hydroxy-4?,7-dimethoxyisoflavan
Common Name English
7-O-Methylvestitol
Common Name English
2?-Isoflavanol, 4?,7-dimethoxy-, (S)-
Common Name English
Phenol, 2-[(3S)-3,4-dihydro-7-methoxy-2H-1-benzopyran-3-yl]-5-methoxy-
Systematic Name English
(3S)-7-O-Methylvestitol
Common Name English
2-[(3S)-3,4-Dihydro-7-methoxy-2H-1-benzopyran-3-yl]-5-methoxyphenol
Systematic Name English
Code System Code Type Description
PUBCHEM
44446856
Created by admin on Wed Apr 02 21:09:55 GMT 2025 , Edited by admin on Wed Apr 02 21:09:55 GMT 2025
PRIMARY
FDA UNII
4H3VM57U2D
Created by admin on Wed Apr 02 21:09:55 GMT 2025 , Edited by admin on Wed Apr 02 21:09:55 GMT 2025
PRIMARY
CAS
20879-02-1
Created by admin on Wed Apr 02 21:09:55 GMT 2025 , Edited by admin on Wed Apr 02 21:09:55 GMT 2025
PRIMARY
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