ADHYPERFORIN

Details

Stereochemistry	EPIMERIC
Molecular Formula	C36H54O4
Molecular Weight	550.8116
Optical Activity	UNSPECIFIED
Defined Stereocenters	4 / 5
E/Z Centers	0
Charge	0

SHOW SMILES / InChI

Structure Search

SMILES

CCC(C)C(=O)[C@]12C(=O)[C@](CC=C(C)C)(C[C@H](CC=C(C)C)[C@@]1(C)CCC=C(C)C)C(=O)C(CC=C(C)C)=C2O

InChI

InChIKey=DHPDSOCOUJHGHE-ACJQSPJVSA-N

InChI=1S/C36H54O4/c1-12-27(10)30(37)36-32(39)29(18-16-25(6)7)31(38)35(33(36)40,21-19-26(8)9)22-28(17-15-24(4)5)34(36,11)20-13-14-23(2)3/h14-16,19,27-28,39H,12-13,17-18,20-22H2,1-11H3/t27?,28-,34+,35+,36-/m0/s1

HIDE SMILES / InChI

Molecular Formula	C36H54O4
Molecular Weight	550.8116
Charge	0
Count

Stereochemistry	EPIMERIC
Additional Stereochemistry	No
Defined Stereocenters	4 / 5
E/Z Centers	0
Optical Activity	UNSPECIFIED

Approval Year

Substance Class	Chemical Created by `admin` on `Sat Dec 16 17:13:26 UTC 2023` Edited by `admin` on `Sat Dec 16 17:13:26 UTC 2023`
Record UNII	EC9K3C78V8
Record Status	`Validated (UNII)`
Record Version

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Name

Type

Language

ADHYPERFORIN

Common Name

English

(1R,5S,6R,7S)-4-HYDROXY-6-METHYL-1,3,7-TRIS(3-METHYL-2-BUTEN-1-YL)-5-(2-METHYL-1-OXOBUTYL)-6-(4-METHYL-3-PENTEN-1-YL)BICYCLO(3.3.1)NON-3-ENE-2,9-DIONE

Systematic Name

English

BICYCLO(3.3.1)NON-3-ENE-2,9-DIONE, 4-HYDROXY-6-METHYL-1,3,7-TRIS(3-METHYL-2-BUTENYL)-5-(2-METHYL-1-OXOBUTYL)-6-(4-METHYL-3-PENTENYL)-, (1R-(1.ALPHA.,5.ALPHA.,6.BETA.,7.ALPHA.))-

Systematic Name

English

BICYCLO(3.3.1)NON-3-ENE-2,9-DIONE, 4-HYDROXY-6-METHYL-1,3,7-TRIS(3-METHYL-2-BUTEN-1-YL)-5-(2-METHYL-1-OXOBUTYL)-6-(4-METHYL-3-PENTEN-1-YL)-, (1R,5S,6R,7S)-

Systematic Name

English

Code System Code Type Description

FDA UNII

EC9K3C78V8