ISOLAPPAOL A

Details

Stereochemistry	ABSOLUTE
Molecular Formula	C30H32O9
Molecular Weight	536.5697
Optical Activity	UNSPECIFIED
Defined Stereocenters	4 / 4
E/Z Centers	0
Charge	0

SHOW SMILES / InChI

Structure Search

SMILES

[H][C@]2(CC1=CC=C(O)C(OC)=C1)COC(=O)[C@]2([H])CC3=CC4=C(O[C@@H]([C@H]4CO)C5=CC(OC)=C(O)C=C5)C(OC)=C3

InChI

InChIKey=YMWGUENGTNUIRA-OUZJQUPYSA-N

InChI=1S/C30H32O9/c1-35-25-11-16(4-6-23(25)32)8-19-15-38-30(34)20(19)9-17-10-21-22(14-31)28(39-29(21)27(12-17)37-3)18-5-7-24(33)26(13-18)36-2/h4-7,10-13,19-20,22,28,31-33H,8-9,14-15H2,1-3H3/t19-,20+,22-,28+/m0/s1

HIDE SMILES / InChI

Molecular Formula	C30H32O9
Molecular Weight	536.5697
Charge	0
Count

Stereochemistry	ABSOLUTE
Additional Stereochemistry	No
Defined Stereocenters	4 / 4
E/Z Centers	0
Optical Activity	UNSPECIFIED

Approval Year

Substance Class	Chemical Created by `admin` on `Sat Dec 16 09:45:04 UTC 2023` Edited by `admin` on `Sat Dec 16 09:45:04 UTC 2023`
Record UNII	7LBR7UN9H8
Record Status	`Validated (UNII)`
Record Version

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Name

Type

Language

ISOLAPPAOL A

Common Name

English

(3R,4R)-3-(((2S,3R)-2,3-DIHYDRO-2-(4-HYDROXY-3-METHOXYPHENYL)-3-(HYDROXYMETHYL)-7-METHOXY-5-BENZOFURANYL)METHYL)DIHYDRO-4-((4-HYDROXY-3-METHOXYPHENYL)METHYL)-2(3H)-FURANONE

Systematic Name

English

2(3H)-FURANONE, 3-(((2S,3R)-2,3-DIHYDRO-2-(4-HYDROXY-3-METHOXYPHENYL)-3-(HYDROXYMETHYL)-7-METHOXY-5-BENZOFURANYL)METHYL)DIHYDRO-4-((4-HYDROXY-3-METHOXYPHENYL)METHYL)-, (3R,4R)-

Systematic Name

English

Code System Code Type Description

FDA UNII

7LBR7UN9H8

Created by admin on Sat Dec 16 09:45:04 UTC 2023 , Edited by admin on Sat Dec 16 09:45:04 UTC 2023

PRIMARY

PUBCHEM

162368347

Created by admin on Sat Dec 16 09:45:04 UTC 2023 , Edited by admin on Sat Dec 16 09:45:04 UTC 2023

PRIMARY

CAS

131400-96-9

Created by admin on Sat Dec 16 09:45:04 UTC 2023 , Edited by admin on Sat Dec 16 09:45:04 UTC 2023

PRIMARY

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