MONOTROPEIN

Details

Stereochemistry	ABSOLUTE
Molecular Formula	C16H22O11
Molecular Weight	390.3393
Optical Activity	UNSPECIFIED
Defined Stereocenters	9 / 9
E/Z Centers	0
Charge	0

SHOW SMILES / InChI

Structure Search

SMILES

[H][C@]12C=C[C@](O)(CO)[C@@]1([H])[C@H](O[C@]3([H])O[C@H](CO)[C@@H](O)[C@H](O)[C@H]3O)OC=C2C(O)=O

InChI

InChIKey=HPWWQPXTUDMRBI-NJPMDSMTSA-N

InChI=1S/C16H22O11/c17-3-8-10(19)11(20)12(21)15(26-8)27-14-9-6(1-2-16(9,24)5-18)7(4-25-14)13(22)23/h1-2,4,6,8-12,14-15,17-21,24H,3,5H2,(H,22,23)/t6-,8-,9-,10-,11+,12-,14+,15+,16+/m1/s1

HIDE SMILES / InChI

Molecular Formula	C16H22O11
Molecular Weight	390.3393
Charge	0
Count

Stereochemistry	ABSOLUTE
Additional Stereochemistry	No
Defined Stereocenters	9 / 9
E/Z Centers	0
Optical Activity	UNSPECIFIED

Approval Year

Targets

Primary Target	Pharmacology	Condition	Potency
Apoptosis 155 Target ID: map04210 Sources: https://www.ncbi.nlm.nih.gov/pubmed/25466264	Inhibitor 8297
NF-kappa B signaling pathway 84 Target ID: map04064 Sources: https://www.ncbi.nlm.nih.gov/pubmed/23261679	Inhibitor 8297

PubMed

Title	Date	PubMed
Antinociceptive anti-inflammatory effect of Monotropein isolated from the root of Morinda officinalis.	2005 Oct	16204945

Substance Class	Chemical Created by `admin` on `Fri Dec 15 17:59:37 GMT 2023` Edited by `admin` on `Fri Dec 15 17:59:37 GMT 2023`
Record UNII	0Y61M84O2T
Record Status	`Validated (UNII)`
Record Version

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Name

Type

Language

MONOTROPEIN

Common Name

English

CYCLOPENTA(C)PYRAN-4-CARBOXYLIC ACID, 1-(.BETA.-D-GLUCOPYRANOSYLOXY)-1,4A,7,7A-TETRAHYDRO-7-HYDROXY-7-(HYDROXYMETHYL)-, (1S-(1.ALPHA.,4A.ALPHA.,7.BETA.,7A.ALPHA.))-

Common Name

English

NSC-291303

Code

English

NSC-88926

Code

English

MONOTROPEIN [MI]

Common Name

English

MONOTROPEINE

Common Name

English

CYCLOPENTA(C)PYRAN-4-CARBOXYLIC ACID, 1-(.BETA.-D-GLUCOPYRANOSYLOXY)-1,4A,7,7A-TETRAHYDRO-7-HYDROXY-7-(HYDROXYMETHYL)-, (1S,4AS,7R,7AS)-

Common Name

English

Code System Code Type Description

FDA UNII

0Y61M84O2T