PODOFILOX BENZYLIDENE GLYCOSIDE

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

Structure Search

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[C@]6([H])O[C@]7([H])COC(O[C@@]7([H])[C@H](O)[C@H]6O)C8=CC=CC=C8

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 `Fri Dec 15 15:50:45 GMT 2023` Edited by `admin` on `Fri Dec 15 15:50:45 GMT 2023`
Record UNII	LW8IK05ASY
Record Status	`Validated (UNII)`
Record Version

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Name

Type

Language

PODOFILOX BENZYLIDENE GLYCOSIDE

Common Name

English

NSC-42076

Code

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