BETAENONE F

Details

Stereochemistry	ABSOLUTE
Molecular Formula	C23H38O6
Molecular Weight	410.5442
Optical Activity	UNSPECIFIED
Defined Stereocenters	8 / 8
E/Z Centers	0
Charge	0

SHOW SMILES / InChI

Structure Search

SMILES

[H][C@]12C[C@](C)(O)C[C@@H](C)[C@]1([H])[C@@](C)(C(=O)CCOC(C)=O)[C@@]([H])([C@H](C)CC)[C@](C)(O)C2=O

InChI

InChIKey=FLFBDTRJVACJLZ-JPNFTQASSA-N

InChI=1S/C23H38O6/c1-8-13(2)19-22(6,17(25)9-10-29-15(4)24)18-14(3)11-21(5,27)12-16(18)20(26)23(19,7)28/h13-14,16,18-19,27-28H,8-12H2,1-7H3/t13-,14-,16+,18+,19-,21-,22-,23+/m1/s1

HIDE SMILES / InChI

Molecular Formula	C23H38O6
Molecular Weight	410.5442
Charge	0
Count

Stereochemistry	ABSOLUTE
Additional Stereochemistry	No
Defined Stereocenters	6 / 8
E/Z Centers	0
Optical Activity	UNSPECIFIED

Approval Year

Substance Class	Chemical Created by `admin` on `Sat Dec 16 13:04:09 GMT 2023` Edited by `admin` on `Sat Dec 16 13:04:09 GMT 2023`
Record UNII	3PA5373MPV
Record Status	`Validated (UNII)`
Record Version

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Name

Type

Language

BETAENONE F

Common Name

English

1(2H)-NAPHTHALENONE, 4-(3-(ACETYLOXY)-1-OXOPROPYL)OCTAHYDRO-2,7-DIHYDROXY-2,4,5,7-TETRAMETHYL-3-(1-METHYLPROPYL)-, (2S-(2.ALPHA.,3.BETA.(S*),4.BETA.,4A.BETA.,5.BETA.,7.ALPHA.,8A.ALPHA.))-

Systematic Name

English

1(2H)-NAPHTHALENONE, 4-(3-(ACETYLOXY)-1-OXOPROPYL)OCTAHYDRO-2,7-DIHYDROXY-2,4,5,7-TETRAMETHYL-3-((1R)-1-METHYLPROPYL)-, (2S,3R,4R,4AS,5R,7R,8AS)-

Systematic Name

English

Code System Code Type Description

FDA UNII

3PA5373MPV

Created by admin on Sat Dec 16 13:04:09 GMT 2023 , Edited by admin on Sat Dec 16 13:04:09 GMT 2023

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PUBCHEM

102093874

Created by admin on Sat Dec 16 13:04:09 GMT 2023 , Edited by admin on Sat Dec 16 13:04:09 GMT 2023

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CAS

85269-24-5

Created by admin on Sat Dec 16 13:04:09 GMT 2023 , Edited by admin on Sat Dec 16 13:04:09 GMT 2023

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