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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 SHINPTEROCARPIN

SMILES

[H][C@@]12COC3=C4C=CC(C)(C)OC4=CC=C3[C@]1([H])OC5=CC(O)=CC=C25

InChI

InChIKey=QGPHRCQDTPCIQI-KXBFYZLASA-N
InChI=1S/C20H18O4/c1-20(2)8-7-13-16(24-20)6-5-14-18(13)22-10-15-12-4-3-11(21)9-17(12)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 Sat Dec 16 09:28:35 UTC 2023
Edited
by admin
on Sat Dec 16 09:28:35 UTC 2023
Record UNII
QNW54SFH39
Record Status Validated (UNII)
Record Version
  • Download
Name Type Language
SHINPTEROCARPIN
Common Name English
2H,6H-BENZOFURO(3,2-C)PYRANO(2,3-H)(1)BENZOPYRAN-9-OL, 6A,11A-DIHYDRO-2,2-DIMETHYL-, (6AR,7BR)-
Systematic Name English
Code System Code Type Description
FDA UNII
QNW54SFH39
Created by admin on Sat Dec 16 09:28:35 UTC 2023 , Edited by admin on Sat Dec 16 09:28:35 UTC 2023
PRIMARY
EPA CompTox
DTXSID001316858
Created by admin on Sat Dec 16 09:28:35 UTC 2023 , Edited by admin on Sat Dec 16 09:28:35 UTC 2023
PRIMARY
CAS
157414-04-5
Created by admin on Sat Dec 16 09:28:35 UTC 2023 , Edited by admin on Sat Dec 16 09:28:35 UTC 2023
PRIMARY
PUBCHEM
10336244
Created by admin on Sat Dec 16 09:28:35 UTC 2023 , Edited by admin on Sat Dec 16 09:28:35 UTC 2023
PRIMARY
Related Record Type Details
PARENT -> CONSTITUENT ALWAYS PRESENT