11-KETO-.BETA.-BOSWELLIC ACID

Details

Stereochemistry	ABSOLUTE
Molecular Formula	C30H46O4
Molecular Weight	470.6838
Optical Activity	UNSPECIFIED
Defined Stereocenters	11 / 11
E/Z Centers	0
Charge	0

SHOW SMILES / InChI

Structure of 11-KETO-.BETA.-BOSWELLIC ACID

Structure Search

SMILES

[H][C@@]12[C@@H](C)[C@H](C)CC[C@]1(C)CC[C@]3(C)C2=CC(=O)[C@]4([H])[C@@]5(C)CC[C@@H](O)[C@](C)(C(O)=O)[C@]5([H])CC[C@@]34C

InChI

InChIKey=YIMHGPSYDOGBPI-YZCVQEKWSA-N

InChI=1S/C30H46O4/c1-17-8-11-26(3)14-15-28(5)19(23(26)18(17)2)16-20(31)24-27(4)12-10-22(32)30(7,25(33)34)21(27)9-13-29(24,28)6/h16-18,21-24,32H,8-15H2,1-7H3,(H,33,34)/t17-,18+,21-,22-,23+,24-,26-,27+,28-,29-,30-/m1/s1

HIDE SMILES / InChI

Molecular Formula	C30H46O4
Molecular Weight	470.6838
Charge	0
Count

Stereochemistry	ABSOLUTE
Additional Stereochemistry	No
Defined Stereocenters	11 / 11
E/Z Centers	0
Optical Activity	UNSPECIFIED

Approval Year

Targets

Primary Target	Pharmacology	Condition	Potency
Arachidonate 5-lipoxygenase 49 Target ID: P09917 Gene ID: 240.0 Gene Symbol: ALOX5 Target Organism: Homo sapiens (Human) Sources: https://www.ncbi.nlm.nih.gov/pubmed/23771412	Inhibitor 8297
Nuclear factor erythroid 2-related factor 2 20 Target ID: Q16236 Gene ID: 4780.0 Gene Symbol: NFE2L2 Target Organism: Homo sapiens (Human) Sources: https://www.ncbi.nlm.nih.gov/pubmed/28142143	Activator 1430

Substance Class	Chemical Created by `admin` on `Sat Dec 16 05:52:53 GMT 2023` Edited by `admin` on `Sat Dec 16 05:52:53 GMT 2023`
Record UNII	0S3BIF6H0Q
Record Status	`Validated (UNII)`
Record Version

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Name

Type

Language

11-KETO-.BETA.-BOSWELLIC ACID

Common Name

English

(3.ALPHA.,4.BETA.)-3-HYDROXY-11-OXOURS-12-EN-23-OIC ACID

Common Name

English

11-KETO-.BETA.-BOSWELLIC ACID [DSC]

Common Name

English

KETO-B-BOSWELLIC ACID

Common Name

English

11-KETO-.BETA.-BOSWELLIC ACID (CONSTITUENT OF BOSWELLIA SERRATA) [DSC]

Common Name

English

11-OXO-.BETA.-BOSWELLIC ACID

Common Name

English

3.ALPHA.-HYDROXY-11-OXOURS-12-EN-24-OIC ACID

Common Name

English

Code System Code Type Description

PUBCHEM

9847548

Created by admin on Sat Dec 16 05:52:54 GMT 2023 , Edited by admin on Sat Dec 16 05:52:54 GMT 2023

PRIMARY

EPA CompTox

DTXSID401313244

Created by admin on Sat Dec 16 05:52:54 GMT 2023 , Edited by admin on Sat Dec 16 05:52:54 GMT 2023

PRIMARY

FDA UNII

0S3BIF6H0Q

Created by admin on Sat Dec 16 05:52:54 GMT 2023 , Edited by admin on Sat Dec 16 05:52:54 GMT 2023

PRIMARY

CAS

17019-92-0

Created by admin on Sat Dec 16 05:52:54 GMT 2023 , Edited by admin on Sat Dec 16 05:52:54 GMT 2023

PRIMARY

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