GENTIOPICRIN

Details

Stereochemistry	ABSOLUTE
Molecular Formula	C16H20O9
Molecular Weight	356.3246
Optical Activity	UNSPECIFIED
Defined Stereocenters	7 / 7
E/Z Centers	0
Charge	0

SHOW SMILES / InChI

Structure Search

SMILES

[H][C@@]3(O[C@@H]1OC=C2C(=O)OCC=C2[C@H]1C=C)O[C@H](CO)[C@@H](O)[C@H](O)[C@H]3O

InChI

InChIKey=DUAGQYUORDTXOR-GPQRQXLASA-N

InChI=1S/C16H20O9/c1-2-7-8-3-4-22-14(21)9(8)6-23-15(7)25-16-13(20)12(19)11(18)10(5-17)24-16/h2-3,6-7,10-13,15-20H,1,4-5H2/t7-,10-,11-,12+,13-,15+,16+/m1/s1

HIDE SMILES / InChI

Molecular Formula	C16H20O9
Molecular Weight	356.3246
Charge	0
Count

Stereochemistry	ABSOLUTE
Additional Stereochemistry	No
Defined Stereocenters	7 / 7
E/Z Centers	0
Optical Activity	UNSPECIFIED

Approval Year

Substance Class	Chemical Created by `admin` on `Fri Dec 15 19:41:06 UTC 2023` Edited by `admin` on `Fri Dec 15 19:41:06 UTC 2023`
Record UNII	0WE09Z21RC
Record Status	`Validated (UNII)`
Record Version

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Name

Type

Language

GENTIOPICRIN

Common Name

English

NSC-606402

Code

English

GENTIOPICRIN [MI]

Common Name

English

GENTIOPICROSIDE

Common Name

English

(5R,6S)-5-ETHENYL-6-(.BETA.-D-GLUCOPYRANOSYLOXY)-5,6-DIHYDRO-1H,3H-PYRANO(3,4-C)PYRAN-1-ONE

Common Name

English

Code System Code Type Description

MERCK INDEX

m5702