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Details

Stereochemistry ACHIRAL
Molecular Formula C33H26O10
Molecular Weight 582.5535
Optical Activity NONE
Defined Stereocenters 0 / 0
E/Z Centers 0
Charge 0

SHOW SMILES / InChI
Structure of SANTALIN A

SMILES

COC1=CC2=C(C(CC3=CC=C(O)C(O)=C3)=C4OC5=CC(=O)C(O)=CC5=CC4=C2C(OC)=C1O)C6=CC=C(O)C=C6OC

InChI

InChIKey=PAQLVBBEBYHSEA-UHFFFAOYSA-N
InChI=1S/C33H26O10/c1-40-27-12-17(34)5-6-18(27)29-19-13-28(41-2)31(39)33(42-3)30(19)21-10-16-11-24(37)25(38)14-26(16)43-32(21)20(29)8-15-4-7-22(35)23(36)9-15/h4-7,9-14,34-37,39H,8H2,1-3H3

HIDE SMILES / InChI

Molecular Formula C33H26O10
Molecular Weight 582.5535
Charge 0
Count
Stereochemistry ACHIRAL
Additional Stereochemistry No
Defined Stereocenters 0 / 0
E/Z Centers 0
Optical Activity NONE

Approval Year

Substance Class Chemical
Created
by admin
on Wed Apr 02 10:54:58 GMT 2025
Edited
by admin
on Wed Apr 02 10:54:58 GMT 2025
Record UNII
M7S05DR0QK
Record Status Validated (UNII)
Record Version
  • Download
Name Type Language
9H-BENZO(A)XANTHEN-9-ONE, 6-((3,4-DIHYDROXYPHENYL)METHYL)-2,10-DIHYDROXY-5-(4-HYDROXY-2-METHOXYPHENYL)-1,3-DIMETHOXY-
Preferred Name English
SANTALIN A
Common Name English
6-((3,4-DIHYDROXYPHENYL)METHYL)-2,10-DIHYDROXY-5-(4-HYDROXY-2-METHOXYPHENYL)-1,3-DIMETHOXY-9H-BENZO(A)XANTHEN-9-ONE
Systematic Name English
Code System Code Type Description
ECHA (EC/EINECS)
253-817-1
Created by admin on Wed Apr 02 10:54:58 GMT 2025 , Edited by admin on Wed Apr 02 10:54:58 GMT 2025
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FDA UNII
M7S05DR0QK
Created by admin on Wed Apr 02 10:54:58 GMT 2025 , Edited by admin on Wed Apr 02 10:54:58 GMT 2025
PRIMARY
CAS
38185-48-7
Created by admin on Wed Apr 02 10:54:58 GMT 2025 , Edited by admin on Wed Apr 02 10:54:58 GMT 2025
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EPA CompTox
DTXSID30959113
Created by admin on Wed Apr 02 10:54:58 GMT 2025 , Edited by admin on Wed Apr 02 10:54:58 GMT 2025
PRIMARY
PUBCHEM
5490179
Created by admin on Wed Apr 02 10:54:58 GMT 2025 , Edited by admin on Wed Apr 02 10:54:58 GMT 2025
PRIMARY