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Details

Stereochemistry ABSOLUTE
Molecular Formula C22H24O9
Molecular Weight 432.4206
Optical Activity UNSPECIFIED
Defined Stereocenters 4 / 4
E/Z Centers 0
Charge 0

SHOW SMILES / InChI
Structure of PODOPHYLLINIC ACID

SMILES

COC1=CC(=CC(OC)=C1OC)[C@H]2[C@H]([C@H](CO)[C@@H](O)C3=C2C=C4OCOC4=C3)C(O)=O

InChI

InChIKey=XRBSKUSTLXISAB-XVVDYKMHSA-N
InChI=1S/C22H24O9/c1-27-16-4-10(5-17(28-2)21(16)29-3)18-11-6-14-15(31-9-30-14)7-12(11)20(24)13(8-23)19(18)22(25)26/h4-7,13,18-20,23-24H,8-9H2,1-3H3,(H,25,26)/t13-,18+,19-,20-/m0/s1

HIDE SMILES / InChI

Molecular Formula C22H24O9
Molecular Weight 432.4206
Charge 0
Count
Stereochemistry ABSOLUTE
Additional Stereochemistry No
Defined Stereocenters 4 / 4
E/Z Centers 0
Optical Activity UNSPECIFIED

Approval Year

Substance Class Chemical
Created
by admin
on Sat Dec 16 08:53:21 GMT 2023
Edited
by admin
on Sat Dec 16 08:53:21 GMT 2023
Record UNII
16FK9L3306
Record Status Validated (UNII)
Record Version
  • Download
Name Type Language
PODOPHYLLINIC ACID
Common Name English
PODOPHYLLIC ACIDS, 2,3-TRANS-HYDROXY ACID-
Common Name English
PODOPHYLLIC ACIDS 2,3-TRANS-HYDROXY ACID [MI]
Common Name English
NAPHTHO(2,3-D)-1,3-DIOXOLE-6-CARBOXYLIC ACID, 5,6,7,8-TETRAHYDRO-8-HYDROXY-7-(HYDROXYMETHYL)-5-(3,4,5-TRIMETHOXYPHENYL)-, (5R,6R,7R,8R)-
Common Name English
Code System Code Type Description
MERCK INDEX
m8932
Created by admin on Sat Dec 16 08:53:21 GMT 2023 , Edited by admin on Sat Dec 16 08:53:21 GMT 2023
PRIMARY Merck Index
CAS
1853-37-8
Created by admin on Sat Dec 16 08:53:21 GMT 2023 , Edited by admin on Sat Dec 16 08:53:21 GMT 2023
PRIMARY
PUBCHEM
134632
Created by admin on Sat Dec 16 08:53:21 GMT 2023 , Edited by admin on Sat Dec 16 08:53:21 GMT 2023
PRIMARY
FDA UNII
16FK9L3306
Created by admin on Sat Dec 16 08:53:21 GMT 2023 , Edited by admin on Sat Dec 16 08:53:21 GMT 2023
PRIMARY
EPA CompTox
DTXSID70939954
Created by admin on Sat Dec 16 08:53:21 GMT 2023 , Edited by admin on Sat Dec 16 08:53:21 GMT 2023
PRIMARY