Medicocarpin, (-)-

Details

Stereochemistry	ABSOLUTE
Molecular Formula	C22H24O9
Molecular Weight	432.4206
Optical Activity	( - )
Defined Stereocenters	7 / 7
E/Z Centers	0
Charge	0

SHOW SMILES / InChI

Structure Search

SMILES

COC1=CC2=C(C=C1)[C@@H]3COC4=CC(O[C@@H]5O[C@H](CO)[C@@H](O)[C@H](O)[C@H]5O)=CC=C4[C@@H]3O2

InChI

InChIKey=PVEMGMOWXQUWRD-NJAOXFEXSA-N

InChI=1S/C22H24O9/c1-27-10-2-4-12-14-9-28-15-7-11(3-5-13(15)21(14)30-16(12)6-10)29-22-20(26)19(25)18(24)17(8-23)31-22/h2-7,14,17-26H,8-9H2,1H3/t14-,17+,18+,19-,20+,21-,22+/m0/s1

HIDE SMILES / InChI

Molecular Formula	C22H24O9
Molecular Weight	432.4206
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 `Mon Mar 31 20:24:00 GMT 2025` Edited by `admin` on `Mon Mar 31 20:24:00 GMT 2025`
Record UNII	87822F2QJH
Record Status	`Validated (UNII)`
Record Version

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Name

Type

Language

Medicocarpin, (-)-

Common Name

English

(-)-Medicocarpin

Preferred Name

English

Medicarpin ?-D-glucoside

Common Name

English

(2R,3S,4S,5R,6S)-2-(hydroxymethyl)-6-{[(1R,10R)-14-methoxy-8,17-dioxatetracyclo[8.7.0.0^{2,7}.0^{11,16}]heptadeca-2,4,6,11(16),12,14-hexaen-5-yl]oxy}oxane-3,4,5-triol

Systematic Name

English

Medicarpin 3-O-glucoside

Common Name

English

Medicocarpin

Common Name

English

?-D-Glucopyranoside, 6a,11a-dihydro-9-methoxy-6H-benzofuro[3,2-c][1]benzopyran-3-yl, (6aR-cis)-

Common Name

English

Medicarpin 3-O-?-D-glucopyranoside

Common Name

English

(6aR,11aR)-6a,11a-Dihydro-9-methoxy-6H-benzofuro[3,2-c][1]benzopyran-3-yl ?-D-glucopyranoside

Systematic Name

English

?-D-Glucopyranoside, (6aR,11aR)-6a,11a-dihydro-9-methoxy-6H-benzofuro[3,2-c][1]benzopyran-3-yl

Common Name

English

Medicarpin glucoside

Common Name

English

Code System Code Type Description

EPA CompTox

DTXSID501312756

Created by admin on Mon Mar 31 20:24:00 GMT 2025 , Edited by admin on Mon Mar 31 20:24:00 GMT 2025

PRIMARY

CAS

52766-70-8

Created by admin on Mon Mar 31 20:24:00 GMT 2025 , Edited by admin on Mon Mar 31 20:24:00 GMT 2025

PRIMARY

FDA UNII

87822F2QJH

Created by admin on Mon Mar 31 20:24:00 GMT 2025 , Edited by admin on Mon Mar 31 20:24:00 GMT 2025

PRIMARY

PUBCHEM

23724664

Created by admin on Mon Mar 31 20:24:00 GMT 2025 , Edited by admin on Mon Mar 31 20:24:00 GMT 2025

PRIMARY

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Medicocarpin, (+)-

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