FILIXIC ACID PBB

Details

Stereochemistry	ACHIRAL
Molecular Formula	C35H42O12
Molecular Weight	654.7008
Optical Activity	NONE
Defined Stereocenters	0 / 0
E/Z Centers	0
Charge	0

SHOW SMILES / InChI

Structure Search

SMILES

CCCC(=O)C1=C(O)C(CC2=C(O)C(C)(C)C(O)=C(C(=O)CCC)C2=O)=C(O)C(CC3=C(O)C(C)(C)C(O)=C(C(=O)CC)C3=O)=C1O

InChI

InChIKey=FQQZLMBKBGEPRC-UHFFFAOYSA-N

InChI=1S/C35H42O12/c1-8-11-20(37)22-26(40)15(13-17-28(42)23(19(36)10-3)32(46)34(4,5)30(17)44)25(39)16(27(22)41)14-18-29(43)24(21(38)12-9-2)33(47)35(6,7)31(18)45/h39-41,44-47H,8-14H2,1-7H3

HIDE SMILES / InChI

Molecular Formula	C35H42O12
Molecular Weight	654.7008
Charge	0
Count

Stereochemistry	ACHIRAL
Additional Stereochemistry	No
Defined Stereocenters	0 / 0
E/Z Centers	0
Optical Activity	NONE

Approval Year

Substance Class	Chemical Created by `admin` on `Mon Mar 31 22:51:42 GMT 2025` Edited by `admin` on `Mon Mar 31 22:51:42 GMT 2025`
Record UNII	NCC470205T
Record Status	`Validated (UNII)`
Record Version

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Name

Type

Language

FILIXIC ACID PBB

Common Name

English

FILIXIC ACIDS PBB [MI]

Preferred Name

English

2,5-CYCLOHEXADIEN-1-ONE, 2-((3-((2,4-DIHYDROXY-3,3-DIMETHYL-6-OXO-5-(1-OXOBUTYL)-1,4-CYCLOHEXADIEN-1-YL)METHYL)-2,4,6-TRIHYDROXY-5-(1-OXOBUTYL)PHENYL)METHYL)-3,5-DIHYDROXY-4,4-DIMETHYL-6-(1-OXOPROPYL)-

Systematic Name

English

Code System Code Type Description

PUBCHEM

20055091

Created by admin on Mon Mar 31 22:51:42 GMT 2025 , Edited by admin on Mon Mar 31 22:51:42 GMT 2025

PRIMARY

CAS

49582-09-4

Created by admin on Mon Mar 31 22:51:42 GMT 2025 , Edited by admin on Mon Mar 31 22:51:42 GMT 2025

PRIMARY

FDA UNII

NCC470205T

Created by admin on Mon Mar 31 22:51:42 GMT 2025 , Edited by admin on Mon Mar 31 22:51:42 GMT 2025

PRIMARY