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Details

Stereochemistry ABSOLUTE
Molecular Formula C20H18O4
Molecular Weight 322.3545
Optical Activity UNSPECIFIED
Defined Stereocenters 2 / 2
E/Z Centers 0
Charge 0

SHOW SMILES / InChI
Structure of Neorautenol, (-)-

SMILES

CC1(C)OC2=C(C=C1)C=C3[C@H]4OC5=CC(O)=CC=C5[C@@H]4COC3=C2

InChI

InChIKey=OGFFMQWYZCTXCM-HNAYVOBHSA-N
InChI=1S/C20H18O4/c1-20(2)6-5-11-7-14-17(9-16(11)24-20)22-10-15-13-4-3-12(21)8-18(13)23-19(14)15/h3-9,15,19,21H,10H2,1-2H3/t15-,19+/m0/s1

HIDE SMILES / InChI

Molecular Formula C20H18O4
Molecular Weight 322.3545
Charge 0
Count
Stereochemistry ABSOLUTE
Additional Stereochemistry No
Defined Stereocenters 2 / 2
E/Z Centers 0
Optical Activity UNSPECIFIED

Approval Year

Substance Class Chemical
Created
by admin
on Wed Apr 02 08:02:06 GMT 2025
Edited
by admin
on Wed Apr 02 08:02:06 GMT 2025
Record UNII
NF6JUS6BNH
Record Status Validated (UNII)
Record Version
  • Download
Name Type Language
Neorautenol, (-)-
Common Name English
(-)-Neorautenol
Preferred Name English
3H,7H-Benzofuro[3,2-c]pyrano[3,2-g][1]benzopyran-10-ol, 7a,12a-dihydro-3,3-dimethyl-, (7aR,12aS)-
Systematic Name English
(7aR,12aS)-7a,12a-Dihydro-3,3-dimethyl-3H,7H-benzofuro[3,2-c]pyrano[3,2-g][1]benzopyran-10-ol
Systematic Name English
3H,7H-Benzofuro[3,2-c]pyrano[3,2-g][1]benzopyran-10-ol, 7a,12a-dihydro-3,3-dimethyl-, (7aR-cis)-
Systematic Name English
Neorautenol
Common Name English
Code System Code Type Description
CAS
53766-52-2
Created by admin on Wed Apr 02 08:02:06 GMT 2025 , Edited by admin on Wed Apr 02 08:02:06 GMT 2025
NON-SPECIFIC STEREOCHEMISTRY
FDA UNII
NF6JUS6BNH
Created by admin on Wed Apr 02 08:02:06 GMT 2025 , Edited by admin on Wed Apr 02 08:02:06 GMT 2025
PRIMARY
PUBCHEM
11500744
Created by admin on Wed Apr 02 08:02:06 GMT 2025 , Edited by admin on Wed Apr 02 08:02:06 GMT 2025
PRIMARY