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Details

Stereochemistry ABSOLUTE
Molecular Formula C22H22O8
Molecular Weight 414.4053
Optical Activity UNSPECIFIED
Defined Stereocenters 4 / 4
E/Z Centers 0
Charge 0

SHOW SMILES / InChI
Structure of PICROPODOPHYLLIN

SMILES

[H][C@]12COC(=O)[C@@]1([H])[C@H](C3=CC(OC)=C(OC)C(OC)=C3)C4=C(C=C5OCOC5=C4)[C@@H]2O

InChI

InChIKey=YJGVMLPVUAXIQN-HAEOHBJNSA-N
InChI=1S/C22H22O8/c1-25-16-4-10(5-17(26-2)21(16)27-3)18-11-6-14-15(30-9-29-14)7-12(11)20(23)13-8-28-22(24)19(13)18/h4-7,13,18-20,23H,8-9H2,1-3H3/t13-,18+,19+,20-/m0/s1

HIDE SMILES / InChI

Molecular Formula C22H22O8
Molecular Weight 414.4053
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 Fri Dec 15 15:19:47 UTC 2023
Edited
by admin
on Fri Dec 15 15:19:47 UTC 2023
Record UNII
0F35AOI227
Record Status Validated (UNII)
Record Version
  • Download
Name Type Language
PICROPODOPHYLLIN
WHO-DD  
Common Name English
AXL1717
Common Name English
NSC-36407
Code English
(5R,5AS,8AR,9R)-9-HYDROXY-5-(3,4,5-TRIMETHOXYPHENYL)-5,5A,8A,9-TETRAHYDROFURO(3',4':6,7)NAPHTHO(2,3-D)(1,3)DIOXOL-6(8H)-ONE
Systematic Name English
PODOPHYLLOTOXIN PICROPODOPHYLLIN
MI  
Common Name English
PODOPHYLLOTOXIN IMPURITY A [EP IMPURITY]
Common Name English
PODOPHYLLOTOXIN PICROPODOPHYLLIN [MI]
Common Name English
Picropodophyllin [WHO-DD]
Common Name English
PICROPODOPHYLLOTOXIN
Common Name English
AXL-1717
Common Name English
Classification Tree Code System Code
NCI_THESAURUS C1331
Created by admin on Fri Dec 15 15:19:47 UTC 2023 , Edited by admin on Fri Dec 15 15:19:47 UTC 2023
FDA ORPHAN DRUG 593617
Created by admin on Fri Dec 15 15:19:47 UTC 2023 , Edited by admin on Fri Dec 15 15:19:47 UTC 2023
NCI_THESAURUS C1967
Created by admin on Fri Dec 15 15:19:47 UTC 2023 , Edited by admin on Fri Dec 15 15:19:47 UTC 2023
EU-Orphan Drug EU/3/17/1904
Created by admin on Fri Dec 15 15:19:47 UTC 2023 , Edited by admin on Fri Dec 15 15:19:47 UTC 2023
Code System Code Type Description
EPA CompTox
DTXSID80197245
Created by admin on Fri Dec 15 15:19:47 UTC 2023 , Edited by admin on Fri Dec 15 15:19:47 UTC 2023
PRIMARY
MESH
C415032
Created by admin on Fri Dec 15 15:19:47 UTC 2023 , Edited by admin on Fri Dec 15 15:19:47 UTC 2023
PRIMARY
CHEBI
75251
Created by admin on Fri Dec 15 15:19:47 UTC 2023 , Edited by admin on Fri Dec 15 15:19:47 UTC 2023
PRIMARY
PUBCHEM
72435
Created by admin on Fri Dec 15 15:19:47 UTC 2023 , Edited by admin on Fri Dec 15 15:19:47 UTC 2023
PRIMARY
FDA UNII
0F35AOI227
Created by admin on Fri Dec 15 15:19:47 UTC 2023 , Edited by admin on Fri Dec 15 15:19:47 UTC 2023
PRIMARY
EVMPD
SUB33043
Created by admin on Fri Dec 15 15:19:47 UTC 2023 , Edited by admin on Fri Dec 15 15:19:47 UTC 2023
PRIMARY
SMS_ID
100000126372
Created by admin on Fri Dec 15 15:19:47 UTC 2023 , Edited by admin on Fri Dec 15 15:19:47 UTC 2023
PRIMARY
MERCK INDEX
m8933
Created by admin on Fri Dec 15 15:19:47 UTC 2023 , Edited by admin on Fri Dec 15 15:19:47 UTC 2023
PRIMARY Merck Index
DRUG BANK
DB12802
Created by admin on Fri Dec 15 15:19:47 UTC 2023 , Edited by admin on Fri Dec 15 15:19:47 UTC 2023
PRIMARY
CAS
477-47-4
Created by admin on Fri Dec 15 15:19:47 UTC 2023 , Edited by admin on Fri Dec 15 15:19:47 UTC 2023
PRIMARY
NSC
36407
Created by admin on Fri Dec 15 15:19:47 UTC 2023 , Edited by admin on Fri Dec 15 15:19:47 UTC 2023
PRIMARY
ChEMBL
CHEMBL283120
Created by admin on Fri Dec 15 15:19:47 UTC 2023 , Edited by admin on Fri Dec 15 15:19:47 UTC 2023
PRIMARY
NCI_THESAURUS
C87736
Created by admin on Fri Dec 15 15:19:47 UTC 2023 , Edited by admin on Fri Dec 15 15:19:47 UTC 2023
PRIMARY
Related Record Type Details
PARENT -> IMPURITY
CHROMATOGRAPHIC PURITY (HPLC/UV)
EP