ETOPOSIDE GLUCURONIDE

Details

Stereochemistry	ABSOLUTE
Molecular Formula	C35H40O19
Molecular Weight	764.6807
Optical Activity	UNSPECIFIED
Defined Stereocenters	15 / 15
E/Z Centers	0
Charge	0

SHOW SMILES / InChI

Structure Search

SMILES

COC1=CC(=CC(OC)=C1O[C@@H]2O[C@@H]([C@@H](O)[C@H](O)[C@H]2O)C(O)=O)[C@H]3[C@@H]4[C@H](COC4=O)[C@H](O[C@@H]5O[C@@H]6CO[C@@H](C)O[C@H]6[C@H](O)[C@H]5O)C7=C3C=C8OCOC8=C7

InChI

InChIKey=URCVASXWNJQAEH-HDWVWLDDSA-N

InChI=1S/C35H40O19/c1-11-46-9-20-30(50-11)25(38)27(40)34(51-20)52-28-14-7-17-16(48-10-49-17)6-13(14)21(22-15(28)8-47-33(22)43)12-4-18(44-2)29(19(5-12)45-3)53-35-26(39)23(36)24(37)31(54-35)32(41)42/h4-7,11,15,20-28,30-31,34-40H,8-10H2,1-3H3,(H,41,42)/t11-,15+,20-,21-,22+,23+,24+,25-,26-,27-,28-,30-,31+,34+,35-/m1/s1

HIDE SMILES / InChI

Molecular Formula	C35H40O19
Molecular Weight	764.6807
Charge	0
Count

Stereochemistry	ABSOLUTE
Additional Stereochemistry	No
Defined Stereocenters	15 / 15
E/Z Centers	0
Optical Activity	UNSPECIFIED

Approval Year

Substance Class	Chemical Created by `admin` on `Mon Mar 31 21:53:46 GMT 2025` Edited by `admin` on `Mon Mar 31 21:53:46 GMT 2025`
Record UNII	F65IJO84A1
Record Status	`Validated (UNII)`
Record Version

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Name

Type

Language

ETOPOSIDE 4'-GLUCURONIDE

Preferred Name

English

ETOPOSIDE GLUCURONIDE

Common Name

English

.BETA.-D-GLUCOPYRANOSIDURONIC ACID, 4-((5R,5AR,8AR,9S)-9-((4,6-O-(1R)-ETHYLIDENE-.BETA.-D-GLUCOPYRANOSYL)OXY)-5,5A,6,8,8A,9-HEXAHYDRO-6-OXOFURO(3',4':6,7)NAPHTHO(2,3-D)-1,3-DIOXOL-5-YL)-2,6-DIMETHOXYPHENYL

Systematic Name

English

Code System Code Type Description

FDA UNII

F65IJO84A1

Created by admin on Mon Mar 31 21:53:46 GMT 2025 , Edited by admin on Mon Mar 31 21:53:46 GMT 2025

PRIMARY

PUBCHEM

46173784

Created by admin on Mon Mar 31 21:53:46 GMT 2025 , Edited by admin on Mon Mar 31 21:53:46 GMT 2025

PRIMARY

EPA CompTox

DTXSID70905159

Created by admin on Mon Mar 31 21:53:46 GMT 2025 , Edited by admin on Mon Mar 31 21:53:46 GMT 2025

PRIMARY

CAS

100007-55-4

Created by admin on Mon Mar 31 21:53:46 GMT 2025 , Edited by admin on Mon Mar 31 21:53:46 GMT 2025

PRIMARY

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ETOPOSIDE

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