TANGHININ

Details

Stereochemistry	ABSOLUTE
Molecular Formula	C32H46O10
Molecular Weight	590.7016
Optical Activity	UNSPECIFIED
Defined Stereocenters	14 / 14
E/Z Centers	0
Charge	0

SHOW SMILES / InChI

Structure Search

SMILES

CO[C@@H]1[C@@H](O)[C@H](C)O[C@@H](O[C@H]2CC[C@@]3(C)[C@H](C[C@@H]4O[C@]45[C@@H]3CC[C@]6(C)[C@H](CC[C@]56O)C7=CC(=O)OC7)C2)[C@H]1OC(C)=O

InChI

InChIKey=BTRWTSHCXGFFFL-NNYOWCKQSA-N

InChI=1S/C32H46O10/c1-16-25(35)26(37-5)27(40-17(2)33)28(39-16)41-20-6-9-29(3)19(13-20)14-23-32(42-23)22(29)8-10-30(4)21(7-11-31(30,32)36)18-12-24(34)38-15-18/h12,16,19-23,25-28,35-36H,6-11,13-15H2,1-5H3/t16-,19-,20-,21+,22+,23-,25-,26+,27-,28-,29-,30+,31+,32+/m0/s1

HIDE SMILES / InChI

Molecular Formula	C32H46O10
Molecular Weight	590.7016
Charge	0
Count

Stereochemistry	ABSOLUTE
Additional Stereochemistry	No
Defined Stereocenters	14 / 14
E/Z Centers	0
Optical Activity	UNSPECIFIED

Approval Year

Substance Class	Chemical Created by `admin` on `Mon Mar 31 22:58:06 GMT 2025` Edited by `admin` on `Mon Mar 31 22:58:06 GMT 2025`
Record UNII	358J7D3ZXI
Record Status	`Validated (UNII)`
Record Version

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Name

Type

Language

TANGHININ

Common Name

English

TANGHINIGENIN 3-((2-O-ACETYL-6-DEOXY-3-O-METHYL-.ALPHA.-L-GLUCOPYRANOSYL)OXY) [MI]

Preferred Name

English

CARD-20(22)-ENOLIDE, 3-((2-O-ACETYL-6-DEOXY-3-O-METHYL-.ALPHA.-L-GLUCOPYRANOSYL)OXY)-7,8-EPOXY-14-HYDROXY-, (3.BETA.,5.BETA.,7.BETA.)-

Systematic Name

English

Code System Code Type Description

PUBCHEM

20055044