BISVERTINOQUINOL

Details

Stereochemistry	ABSOLUTE
Molecular Formula	C28H34O8
Molecular Weight	498.5648
Optical Activity	UNSPECIFIED
Defined Stereocenters	6 / 6
E/Z Centers	4
Charge	0

SHOW SMILES / InChI

Structure Search

SMILES

C\C=C\CCC(=O)[C@@]12[C@H]([C@H]3\C(=C(O)/C=C/C=C/C)C(=O)[C@]1(C)C(=O)[C@@]3(C)O)[C@](C)(O)C(O)=C(C)C2=O

InChI

InChIKey=ZXWVVZIMJSPORF-FTTFQXIBSA-N

InChI=1S/C28H34O8/c1-7-9-11-13-16(29)18-19-20-27(6,36)21(31)15(3)22(32)28(20,17(30)14-12-10-8-2)25(4,23(18)33)24(34)26(19,5)35/h7-11,13,19-20,29,31,35-36H,12,14H2,1-6H3/b9-7+,10-8+,13-11+,18-16-/t19-,20-,25-,26+,27+,28+/m1/s1

HIDE SMILES / InChI

Molecular Formula	C28H34O8
Molecular Weight	498.5648
Charge	0
Count

Stereochemistry	ABSOLUTE
Additional Stereochemistry	No
Defined Stereocenters	6 / 6
E/Z Centers	3
Optical Activity	UNSPECIFIED

Approval Year

Substance Class	Chemical Created by `admin` on `Mon Mar 31 23:16:40 GMT 2025` Edited by `admin` on `Mon Mar 31 23:16:40 GMT 2025`
Record UNII	0S5Q28668H
Record Status	`Validated (UNII)`
Record Version

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Name

Type

Language

BISVERTINOQUINOL

Common Name

English

BISVERTINOQUINOL, (+)-

Preferred Name

English

1,4-ETHANONAPHTHALENE-2,8,10-TRIONE, 1,3,4,4A,5,8A-HEXAHYDRO-3,5,6-TRIHYDROXY-9-((2E,4E)-1-HYDROXY-2,4-HEXADIENYLIDENE)-1,3,5,7-TETRAMETHYL-8A-((4E)-1-OXO-4-HEXENYL)-, (1R,3S,4S,4AS,5S,8AR,9Z)-REL-(+)-

Systematic Name

English

1,4-ETHANONAPHTHALENE-2,8,10-TRIONE, 1,3,4,4A,5,8A-HEXAHYDRO-3,5,6-TRIHYDROXY-9-(1-HYDROXY-2,4-HEXADIENYLIDENE)-1,3,5,7-TETRAMETHYL-8A-(1-OXO-4-HEXENYL)-, (1.ALPHA.,3.BETA.,4.ALPHA.,4A.BETA.,5.ALPHA.,8A.BETA.(E),9Z(2E,4E))-(+)-

Systematic Name

English

Code System Code Type Description

CAS

79950-83-7

Created by admin on Mon Mar 31 23:16:40 GMT 2025 , Edited by admin on Mon Mar 31 23:16:40 GMT 2025

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FDA UNII

0S5Q28668H

Created by admin on Mon Mar 31 23:16:40 GMT 2025 , Edited by admin on Mon Mar 31 23:16:40 GMT 2025

PRIMARY

PUBCHEM

118796512

Created by admin on Mon Mar 31 23:16:40 GMT 2025 , Edited by admin on Mon Mar 31 23:16:40 GMT 2025

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