Isocupressic acid, (+)-

Details

Stereochemistry	ABSOLUTE
Molecular Formula	C20H32O3
Molecular Weight	320.4663
Optical Activity	( + )
Defined Stereocenters	4 / 4
E/Z Centers	1
Charge	0

SHOW SMILES / InChI

Structure Search

SMILES

C\C(CC[C@H]1C(=C)CC[C@@H]2[C@]1(C)CCC[C@]2(C)C(O)=O)=C/CO

InChI

InChIKey=DOYKMKZYLAAOGH-DOEMEAPXSA-N

InChI=1S/C20H32O3/c1-14(10-13-21)6-8-16-15(2)7-9-17-19(16,3)11-5-12-20(17,4)18(22)23/h10,16-17,21H,2,5-9,11-13H2,1,3-4H3,(H,22,23)/b14-10+/t16-,17+,19+,20-/m0/s1

HIDE SMILES / InChI

Molecular Formula	C20H32O3
Molecular Weight	320.4663
Charge	0
Count

Stereochemistry	ABSOLUTE
Additional Stereochemistry	No
Defined Stereocenters	4 / 4
E/Z Centers	1
Optical Activity	UNSPECIFIED

Approval Year

Substance Class	Chemical Created by `admin` on `Wed Apr 02 09:17:05 GMT 2025` Edited by `admin` on `Wed Apr 02 09:17:05 GMT 2025`
Record UNII	6DV5EL78HE
Record Status	`Validated (UNII)`
Record Version

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Name

Type

Language

Isocupressic acid, (+)-

Common Name

English

(+)-Isocupressic acid

Preferred Name

English

1-NAPHTHALENECARBOXYLIC ACID, DECAHYDRO-5-(5-HYDROXY-3-METHYL-3-PENTENYL)-1,4A-DIMETHYL-6-METHYLENE-, (1S-(1.ALPHA.,4A.ALPHA.,5.ALPHA.(E),8A.BETA.))-

Systematic Name

English

ISOCUPRESSIC ACID

Common Name

English

(1S,4aR,5S,8aR)-Decahydro-5-[(3E)-5-hydroxy-3-methyl-3-penten-1-yl]-1,4a-dimethyl-6-methylene-1-naphthalenecarboxylic acid

Systematic Name

English

1-NAPHTHALENECARBOXYLIC ACID, DECAHYDRO-5-((3E)-5-HYDROXY-3-METHYL-3-PENTENYL)-1,4A-DIMETHYL-6-METHYLENE-, (1S,4AR,5S,8AR)-

Systematic Name

English

LABDA-8(20),13-DIEN-19-OIC ACID, 15-HYDROXY-, (E)-

Systematic Name

English

Code System Code Type Description

PUBCHEM

6438138