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Details

Stereochemistry UNKNOWN
Molecular Formula C35H36O13
Molecular Weight 664.6525
Optical Activity UNSPECIFIED
Defined Stereocenters 9 / 10
E/Z Centers 0
Charge 0

SHOW SMILES / InChI
Structure of PODOFILOX BENZYLIDENE GLYCOSIDE

SMILES

COC1=CC(=CC(OC)=C1OC)[C@H]2[C@@H]3[C@H](COC3=O)[C@@H](O[C@@H]4O[C@@H]5COC(O[C@H]5[C@H](O)[C@H]4O)C6=CC=CC=C6)C7=CC8=C(OCO8)C=C27

InChI

InChIKey=SBPPWJIDARICBS-PGCXOGMSSA-N
InChI=1S/C35H36O13/c1-39-23-9-17(10-24(40-2)31(23)41-3)26-18-11-21-22(45-15-44-21)12-19(18)30(20-13-42-33(38)27(20)26)47-35-29(37)28(36)32-25(46-35)14-43-34(48-32)16-7-5-4-6-8-16/h4-12,20,25-30,32,34-37H,13-15H2,1-3H3/t20-,25+,26+,27-,28+,29+,30-,32+,34?,35-/m0/s1

HIDE SMILES / InChI

Molecular Formula C35H36O13
Molecular Weight 664.6525
Charge 0
Count
Stereochemistry EPIMERIC
Additional Stereochemistry No
Defined Stereocenters 9 / 10
E/Z Centers 0
Optical Activity UNSPECIFIED

Approval Year

Substance Class Chemical
Created
by admin
on Mon Mar 31 18:10:43 GMT 2025
Edited
by admin
on Mon Mar 31 18:10:43 GMT 2025
Record UNII
LW8IK05ASY
Record Status Validated (UNII)
Record Version
  • Download
Name Type Language
NSC-42076
Preferred Name English
PODOFILOX BENZYLIDENE GLYCOSIDE
Common Name English
PODOPHYLLOTOXIN O-BENZYLIDENE-.BETA.-D-GLUCOPYRANOSIDE
Common Name English
FURO(3',4':6,7)NAPHTHO(2,3-D)-1,3-DIOXOL-6(5AH)-ONE, 5,8,8A,9-TETRAHYDRO-9-((4,6-O-(PHENYLMETHYLENE)-.BETA.-D-GLUCOPYRANOSYL)OXY)-5-(3,4,5-TRIMETHOXYPHENYL)-, (5R,5AR,8AR,9R)-
Systematic Name English
Code System Code Type Description
NSC
42076
Created by admin on Mon Mar 31 18:10:43 GMT 2025 , Edited by admin on Mon Mar 31 18:10:43 GMT 2025
PRIMARY
CAS
3268-19-7
Created by admin on Mon Mar 31 18:10:43 GMT 2025 , Edited by admin on Mon Mar 31 18:10:43 GMT 2025
PRIMARY
EVMPD
SUB14927MIG
Created by admin on Mon Mar 31 18:10:43 GMT 2025 , Edited by admin on Mon Mar 31 18:10:43 GMT 2025
PRIMARY
PUBCHEM
73047
Created by admin on Mon Mar 31 18:10:43 GMT 2025 , Edited by admin on Mon Mar 31 18:10:43 GMT 2025
PRIMARY
FDA UNII
LW8IK05ASY
Created by admin on Mon Mar 31 18:10:43 GMT 2025 , Edited by admin on Mon Mar 31 18:10:43 GMT 2025
PRIMARY
EPA CompTox
DTXSID90911575
Created by admin on Mon Mar 31 18:10:43 GMT 2025 , Edited by admin on Mon Mar 31 18:10:43 GMT 2025
PRIMARY