PEONIFLORIN

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National Institutes of Health Divider Arrow

NCATS

Details

Stereochemistry	ABSOLUTE
Molecular Formula	C23H28O11
Molecular Weight	480.4618
Optical Activity	UNSPECIFIED
Defined Stereocenters	11 / 11
E/Z Centers	0
Charge	0

SHOW SMILES / InChI

Structure of PEONIFLORIN

Structure Search

SMILES

[H][C@@]12C[C@@]4(O[C@]3([H])O[C@H](CO)[C@@H](O)[C@H](O)[C@H]3O)[C@]1(COC(=O)C5=CC=CC=C5)[C@@]6([H])O[C@]2(O)C[C@]4(C)O6

InChI

InChIKey=YKRGDOXKVOZESV-WRJNSLSBSA-N

InChI=1S/C23H28O11/c1-20-9-22(29)13-7-23(20,32-18-16(27)15(26)14(25)12(8-24)31-18)21(13,19(33-20)34-22)10-30-17(28)11-5-3-2-4-6-11/h2-6,12-16,18-19,24-27,29H,7-10H2,1H3/t12-,13-,14-,15+,16-,18+,19-,20+,21+,22-,23+/m1/s1

HIDE SMILES / InChI

Molecular Formula	C23H28O11
Molecular Weight	480.4618
Charge	0
Count

Stereochemistry	ABSOLUTE
Additional Stereochemistry	No
Defined Stereocenters	11 / 11
E/Z Centers	0
Optical Activity	UNSPECIFIED

Approval Year

Substance Class	Chemical Created by `admin` on `Fri Dec 15 16:02:57 UTC 2023` Edited by `admin` on `Fri Dec 15 16:02:57 UTC 2023`
Record UNII	21AIQ4EV64
Record Status	`Validated (UNII)`
Record Version

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Name

Type

Language

PEONIFLORIN

Official Name

English

.BETA.-D-GLUCOPYRANOSIDE, 5B-((BENZOYLOXY)METHYL)TETRAHYDRO-5-HYDROXY-2-METHYL-2,5-METHANO-1H-3,4-DIOXACYCLOBUTA(CD)PENTALEN-1A(2H)-YL, (1AR-(1A.ALPHA.,2.BETA.,3A.ALPHA.,5.ALPHA.,5A.ALPHA.,5B.ALPHA.))-

Common Name

English

PAEONIFLORIN

Common Name

English

PAEONIFLORIN [USP-RS]

Common Name

English

.BETA.-D-GLUCOPYRANOSIDE, (1AR,2S,3AR,5R,5AR,5BS)-5B-((BENZOYLOXY)METHYL)TETRAHYDRO-5-HYDROXY-2-METHYL-2,5-METHANO-1H-3,4-DIOXACYCLOBUTA(CD)PENTALEN-1A(2H)-YL

Common Name

English

PEONIFLORIN [INCI]

Common Name

English

NSC-178886

Code

English

Classification Tree Code System Code

DSLD

3250 (Number of products:2)

Created by admin on Fri Dec 15 16:02:57 UTC 2023 , Edited by admin on Fri Dec 15 16:02:57 UTC 2023

Code System Code Type Description

NSC

178886

Created by admin on Fri Dec 15 16:02:57 UTC 2023 , Edited by admin on Fri Dec 15 16:02:57 UTC 2023

PRIMARY

ECHA (EC/EINECS)

245-476-2

Created by admin on Fri Dec 15 16:02:57 UTC 2023 , Edited by admin on Fri Dec 15 16:02:57 UTC 2023

PRIMARY

EPA CompTox

DTXSID2042648

Created by admin on Fri Dec 15 16:02:57 UTC 2023 , Edited by admin on Fri Dec 15 16:02:57 UTC 2023

PRIMARY

WIKIPEDIA

PAEONIFLORIN

Created by admin on Fri Dec 15 16:02:57 UTC 2023 , Edited by admin on Fri Dec 15 16:02:57 UTC 2023

PRIMARY

PUBCHEM

442534

Created by admin on Fri Dec 15 16:02:57 UTC 2023 , Edited by admin on Fri Dec 15 16:02:57 UTC 2023

PRIMARY

RS_ITEM_NUM

1491616

Created by admin on Fri Dec 15 16:02:57 UTC 2023 , Edited by admin on Fri Dec 15 16:02:57 UTC 2023

PRIMARY

RXCUI

2288155

Created by admin on Fri Dec 15 16:02:57 UTC 2023 , Edited by admin on Fri Dec 15 16:02:57 UTC 2023

PRIMARY

DAILYMED

21AIQ4EV64

Created by admin on Fri Dec 15 16:02:57 UTC 2023 , Edited by admin on Fri Dec 15 16:02:57 UTC 2023

PRIMARY

FDA UNII

21AIQ4EV64

Created by admin on Fri Dec 15 16:02:57 UTC 2023 , Edited by admin on Fri Dec 15 16:02:57 UTC 2023

PRIMARY

CAS

23180-57-6

Created by admin on Fri Dec 15 16:02:57 UTC 2023 , Edited by admin on Fri Dec 15 16:02:57 UTC 2023

PRIMARY

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PAEONIA LACTIFLORA ROOT

CONSTITUENT ALWAYS PRESENT -> PARENT

Comments:

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PAEONIA VEITCHII ROOT

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					3Z3866YW6P

PAEONIA LACTIFLORA ROOT

CONSTITUENT ALWAYS PRESENT -> PARENT

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					BUG255FE7X

PAEONIA X SUFFRUTICOSA ROOT BARK

PARENT -> CONSTITUENT ALWAYS PRESENT

Comments:

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					3Z3866YW6P

PAEONIA LACTIFLORA ROOT

CONSTITUENT ALWAYS PRESENT -> PARENT