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Details

Stereochemistry ABSOLUTE
Molecular Formula C16H16O6
Molecular Weight 304.2946
Optical Activity UNSPECIFIED
Defined Stereocenters 2 / 2
E/Z Centers 0
Charge 0

SHOW SMILES / InChI
Structure of SAPPANOL

SMILES

O[C@H]1C2=CC=C(O)C=C2OC[C@]1(O)CC3=CC(O)=C(O)C=C3

InChI

InChIKey=MPGFEHZDABUJFR-JKSUJKDBSA-N
InChI=1S/C16H16O6/c17-10-2-3-11-14(6-10)22-8-16(21,15(11)20)7-9-1-4-12(18)13(19)5-9/h1-6,15,17-21H,7-8H2/t15-,16+/m0/s1

HIDE SMILES / InChI

Molecular Formula C16H16O6
Molecular Weight 304.2946
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 17:29:13 GMT 2023
Edited
by admin
on Sat Dec 16 17:29:13 GMT 2023
Record UNII
98CDE6U7UL
Record Status Validated (UNII)
Record Version
  • Download
Name Type Language
SAPPANOL
Common Name English
(3R,4S)-3-((3,4-DIHYDROXYPHENYL)METHYL)-3,4-DIHYDRO-2H-1-BENZOPYRAN-3,4,7-TRIOL
Systematic Name English
2H-1-BENZOPYRAN-3,4,7-TRIOL, 3-((3,4-DIHYDROXYPHENYL)METHYL)-3,4-DIHYDRO-, (3R,4S)-
Systematic Name English
2H-1-BENZOPYRAN-3,4,7-TRIOL, 3-((3,4-DIHYDROXYPHENYL)METHYL)-3,4-DIHYDRO-, (3R-CIS)-
Systematic Name English
Code System Code Type Description
WIKIPEDIA
Sappanol
Created by admin on Sat Dec 16 17:29:13 GMT 2023 , Edited by admin on Sat Dec 16 17:29:13 GMT 2023
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FDA UNII
98CDE6U7UL
Created by admin on Sat Dec 16 17:29:13 GMT 2023 , Edited by admin on Sat Dec 16 17:29:13 GMT 2023
PRIMARY
CAS
111254-19-4
Created by admin on Sat Dec 16 17:29:13 GMT 2023 , Edited by admin on Sat Dec 16 17:29:13 GMT 2023
PRIMARY
PUBCHEM
13846648
Created by admin on Sat Dec 16 17:29:13 GMT 2023 , Edited by admin on Sat Dec 16 17:29:13 GMT 2023
PRIMARY
EPA CompTox
DTXSID501031877
Created by admin on Sat Dec 16 17:29:13 GMT 2023 , Edited by admin on Sat Dec 16 17:29:13 GMT 2023
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