QUINOVIC ACID GLYCOSIDE 2

Details

Stereochemistry	ABSOLUTE
Molecular Formula	C42H66O14
Molecular Weight	794.965
Optical Activity	UNSPECIFIED
Defined Stereocenters	20 / 20
E/Z Centers	0
Charge	0

SHOW SMILES / InChI

Structure Search

SMILES

[H][C@@]6(O[C@H]1CC[C@@]2(C)[C@@]([H])(CC[C@]3(C)[C@]2([H])CC=C4[C@]5([H])[C@@H](C)[C@H](C)CC[C@@]5(CC[C@@]34C(O)=O)C(O)=O)C1(C)C)O[C@H](C)[C@H](O)[C@H](O[C@]7([H])O[C@H](CO)[C@@H](O)[C@H](O)[C@H]7O)[C@H]6O

InChI

InChIKey=BZXXSUZFEIFGEX-LCSOEGAZSA-N

InChI=1S/C42H66O14/c1-19-10-15-41(36(49)50)16-17-42(37(51)52)22(27(41)20(19)2)8-9-25-39(6)13-12-26(38(4,5)24(39)11-14-40(25,42)7)55-35-32(48)33(28(44)21(3)53-35)56-34-31(47)30(46)29(45)23(18-43)54-34/h8,19-21,23-35,43-48H,9-18H2,1-7H3,(H,49,50)(H,51,52)/t19-,20+,21-,23-,24+,25-,26+,27+,28+,29-,30+,31-,32-,33+,34+,35+,39+,40-,41+,42-/m1/s1

HIDE SMILES / InChI

Molecular Formula	C42H66O14
Molecular Weight	794.965
Charge	0
Count

Stereochemistry	ABSOLUTE
Additional Stereochemistry	No
Defined Stereocenters	20 / 20
E/Z Centers	0
Optical Activity	UNSPECIFIED

Approval Year

Substance Class	Chemical Created by `admin` on `Sat Dec 16 02:15:15 UTC 2023` Edited by `admin` on `Sat Dec 16 02:15:15 UTC 2023`
Record UNII	P84Z2WDZ9J
Record Status	`Validated (UNII)`
Record Version

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Name

Type

Language

QUINOVIC ACID GLYCOSIDE 2

Common Name

English

URS-12-ENE-27,28-DIOIC ACID, 3-((6-DEOXY-3-O-.BETA.-D-GLUCOPYRANOSYL-.BETA.-D-GALACTOPYRANOSYL)OXY)-, (3.BETA.)-

Systematic Name

English

Code System Code Type Description

CAS

115569-78-3

Created by admin on Sat Dec 16 02:15:15 UTC 2023 , Edited by admin on Sat Dec 16 02:15:15 UTC 2023

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FDA UNII

P84Z2WDZ9J

Created by admin on Sat Dec 16 02:15:15 UTC 2023 , Edited by admin on Sat Dec 16 02:15:15 UTC 2023

PRIMARY

PUBCHEM

44593500

Created by admin on Sat Dec 16 02:15:15 UTC 2023 , Edited by admin on Sat Dec 16 02:15:15 UTC 2023

PRIMARY

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