15-HYDROXYDEHYDROABIETIC ACID

Details

Stereochemistry	ABSOLUTE
Molecular Formula	C20H28O3
Molecular Weight	316.4345
Optical Activity	UNSPECIFIED
Defined Stereocenters	3 / 3
E/Z Centers	0
Charge	0

SHOW SMILES / InChI

Structure of 15-HYDROXYDEHYDROABIETIC ACID

Structure Search

SMILES

CC(C)(O)C1=CC2=C(C=C1)[C@@]3(C)CCC[C@](C)([C@@H]3CC2)C(O)=O

InChI

InChIKey=ILQLITDRYFHAGM-NSISKUIASA-N

InChI=1S/C20H28O3/c1-18(2,23)14-7-8-15-13(12-14)6-9-16-19(15,3)10-5-11-20(16,4)17(21)22/h7-8,12,16,23H,5-6,9-11H2,1-4H3,(H,21,22)/t16-,19-,20-/m1/s1

HIDE SMILES / InChI

Molecular Formula	C20H28O3
Molecular Weight	316.4345
Charge	0
Count

Stereochemistry	ABSOLUTE
Additional Stereochemistry	No
Defined Stereocenters	3 / 3
E/Z Centers	0
Optical Activity	UNSPECIFIED

Approval Year

Substance Class	Chemical Created by `admin` on `Mon Mar 31 19:41:37 GMT 2025` Edited by `admin` on `Mon Mar 31 19:41:37 GMT 2025`
Record UNII	SJT5EC4FM4
Record Status	`Validated (UNII)`
Record Version

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Name

Type

Language

15-HYDROXYDEHYDROABIETIC ACID

Common Name

English

15-HYDROXYDEHYDROABIETIC-ACID

Preferred Name

English

(1R,4AS,10AR)-7-(1-HYDROXY-1-METHYL-ETHYL)-1,4A-DIMETHYL-2,3,4,9,10,10A-HEXAHYDROPHENANTHRENE-1-CARBOXYLIC ACID

Systematic Name

English

1-PHENANTHRENECARBOXYLIC ACID, 1,2,3,4,4A,9,10,10A-OCTAHYDRO-7-(1-HYDROXY-1-METHYLETHYL)-1,4A-DIMETHYL-, (1R-(1.ALPHA.,4A.BETA.,10A.ALPHA.))-

Systematic Name

English

(1R,4AS,10AR)-1,2,3,4,4A,9,10,10A-OCTAHYDRO-7-(1-HYDROXY-1-METHYLETHYL)-1,4A-DIMETHYL-1-PHENANTHRENECARBOXYLIC ACID

Systematic Name

English

15-HYDROXYDEHYDROABIETA-18-OIC ACID

Systematic Name

English

Code System Code Type Description

EPA CompTox

DTXSID201307837

Created by admin on Mon Mar 31 19:41:37 GMT 2025 , Edited by admin on Mon Mar 31 19:41:37 GMT 2025

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CAS

54113-95-0

Created by admin on Mon Mar 31 19:41:37 GMT 2025 , Edited by admin on Mon Mar 31 19:41:37 GMT 2025

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FDA UNII

SJT5EC4FM4

Created by admin on Mon Mar 31 19:41:37 GMT 2025 , Edited by admin on Mon Mar 31 19:41:37 GMT 2025

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PUBCHEM

14487943

Created by admin on Mon Mar 31 19:41:37 GMT 2025 , Edited by admin on Mon Mar 31 19:41:37 GMT 2025

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