SUFFRUTICOSOL B

Details

Stereochemistry	RACEMIC
Molecular Formula	C42H32O9
Molecular Weight	680.6981
Optical Activity	( + / - )
Defined Stereocenters	6 / 6
E/Z Centers	0
Charge	0

SHOW SMILES / InChI

Structure Search

SMILES

[H][C@@]1(OC2=C3C4=C(C(O)=C2)[C@@]([H])(C5=CC(O)=CC(O)=C5)[C@]([H])(C6=CC=C(O)C=C6)[C@]4([H])[C@@]([H])(C7=CC=C(O)C=C7)C8=C(O)C=C(O)C=C8[C@@]13[H])C9=CC=C(O)C=C9

InChI

InChIKey=MBGBQHRAJPLAPN-BTJJUUGGSA-N

InChI=1S/C42H32O9/c43-23-7-1-19(2-8-23)33-35(22-13-26(46)15-27(47)14-22)38-31(50)18-32-39-37(42(51-32)21-5-11-25(45)12-6-21)29-16-28(48)17-30(49)36(29)34(40(33)41(38)39)20-3-9-24(44)10-4-20/h1-18,33-35,37,40,42-50H/t33-,34-,35-,37+,40+,42+/m0/s1

HIDE SMILES / InChI

Molecular Formula	C42H32O9
Molecular Weight	680.6981
Charge	0
Count

Stereochemistry	ABSOLUTE
Additional Stereochemistry	No
Defined Stereocenters	6 / 6
E/Z Centers	0
Optical Activity	UNSPECIFIED

Approval Year

Substance Class	Chemical Created by `admin` on `Sat Dec 16 09:53:28 GMT 2023` Edited by `admin` on `Sat Dec 16 09:53:28 GMT 2023`
Record UNII	XVN93LV7JX
Record Status	`Validated (UNII)`
Record Version

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Name

Type

Language

SUFFRUTICOSOL B

Common Name

English

REL-(3R,4R,4AR,5S,9BR,10S)-3-(3,5-DIHYDROXYPHENYL)-3,4,4A,5,9B,10-HEXAHYDRO-4,5,10-TRIS(4-HYDROXYPHENYL)BENZ(5,6)AZULENO(7,8,1-CDE)BENZOFURAN-2,6,8-TRIOL

Systematic Name

English

BENZ(5,6)AZULENO(7,8,1-CDE)BENZOFURAN-2,6,8-TRIOL, 3-(3,5-DIHYDROXYPHENYL)-3,4,4A,5,9B,10-HEXAHYDRO-4,5,10-TRIS(4-HYDROXYPHENYL)-, (3R,4R,4AR,5S,9BR,10S)-REL-

Systematic Name

English

Code System Code Type Description

PUBCHEM

10652146

Created by admin on Sat Dec 16 09:53:28 GMT 2023 , Edited by admin on Sat Dec 16 09:53:28 GMT 2023

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FDA UNII

XVN93LV7JX

Created by admin on Sat Dec 16 09:53:28 GMT 2023 , Edited by admin on Sat Dec 16 09:53:28 GMT 2023

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CAS

220936-87-8

Created by admin on Sat Dec 16 09:53:28 GMT 2023 , Edited by admin on Sat Dec 16 09:53:28 GMT 2023

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PAEONIA X SUFFRUTICOSA SEED

PARENT -> CONSTITUENT ALWAYS PRESENT

Comments:

Stilbene was determined by means of of a newly developed rapid, sensitive, and accurate HPLC-DAD method.

Amount: