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Details

Stereochemistry EPIMERIC
Molecular Formula C27H32O16
Molecular Weight 612.5334
Optical Activity UNSPECIFIED
Defined Stereocenters 10 / 11
E/Z Centers 1
Charge 0

SHOW SMILES / InChI
Structure of HYDROXYSAFFLOR YELLOW A

SMILES

[H][C@]1(O[C@H](CO)[C@@H](O)[C@H](O)[C@H]1O)C2(O)C(O)=C([C@@H]3O[C@H](CO)[C@@H](O)[C@H](O)[C@H]3O)C(=O)C(C(=O)\C=C\C4=CC=C(O)C=C4)=C2O

InChI

InChIKey=LIPJRCGLQNIXGO-ONZBGLOFSA-N
InChI=1S/C27H32O16/c28-7-12-16(32)19(35)21(37)23(42-12)15-18(34)14(11(31)6-3-9-1-4-10(30)5-2-9)24(39)27(41,25(15)40)26-22(38)20(36)17(33)13(8-29)43-26/h1-6,12-13,16-17,19-23,26,28-30,32-33,35-41H,7-8H2/b6-3+/t12-,13-,16-,17-,19+,20+,21-,22-,23+,26-,27?/m1/s1

HIDE SMILES / InChI

Molecular Formula C27H32O16
Molecular Weight 612.5334
Charge 0
Count
Stereochemistry EPIMERIC
Additional Stereochemistry No
Defined Stereocenters 10 / 11
E/Z Centers 1
Optical Activity UNSPECIFIED

Approval Year

Substance Class Chemical
Created
by admin
on Sat Dec 16 09:23:24 UTC 2023
Edited
by admin
on Sat Dec 16 09:23:24 UTC 2023
Record UNII
HI7O919OYZ
Record Status Validated (UNII)
Record Version
  • Download
Name Type Language
HYDROXYSAFFLOR YELLOW A
Common Name English
2,5-CYCLOHEXADIEN-1-ONE, 2,4-DI-.BETA.-D-GLUCOPYRANOSYL-3,4,5-TRIHYDROXY-6-((2E)-3-(4-HYDROXYPHENYL)-1-OXO-2-PROPEN-1-YL)-
Systematic Name English
HSYA
Common Name English
SAFFLOMIN A
Common Name English
Code System Code Type Description
CAS
78281-02-4
Created by admin on Sat Dec 16 09:23:24 UTC 2023 , Edited by admin on Sat Dec 16 09:23:24 UTC 2023
PRIMARY
FDA UNII
HI7O919OYZ
Created by admin on Sat Dec 16 09:23:24 UTC 2023 , Edited by admin on Sat Dec 16 09:23:24 UTC 2023
PRIMARY
CAS
855782-18-2
Created by admin on Sat Dec 16 09:23:24 UTC 2023 , Edited by admin on Sat Dec 16 09:23:24 UTC 2023
ALTERNATIVE
CHEBI
139030
Created by admin on Sat Dec 16 09:23:24 UTC 2023 , Edited by admin on Sat Dec 16 09:23:24 UTC 2023
PRIMARY
EPA CompTox
DTXSID801031226
Created by admin on Sat Dec 16 09:23:24 UTC 2023 , Edited by admin on Sat Dec 16 09:23:24 UTC 2023
PRIMARY
CAS
1423072-23-4
Created by admin on Sat Dec 16 09:23:24 UTC 2023 , Edited by admin on Sat Dec 16 09:23:24 UTC 2023
ALTERNATIVE
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