ARTELINIC ACID

Details

Stereochemistry	ABSOLUTE
Molecular Formula	C23H30O7
Molecular Weight	418.4801
Optical Activity	UNSPECIFIED
Defined Stereocenters	8 / 8
E/Z Centers	0
Charge	0

SHOW SMILES / InChI

Structure Search

SMILES

[H][C@@]12CC[C@@H](C)[C@]3([H])CC[C@@]4(C)OO[C@@]13[C@]([H])(O[C@H](OCC5=CC=C(C=C5)C(O)=O)[C@@H]2C)O4

InChI

InChIKey=UVNHKOOJXSALHN-ILQPJIFQSA-N

InChI=1S/C23H30O7/c1-13-4-9-18-14(2)20(26-12-15-5-7-16(8-6-15)19(24)25)27-21-23(18)17(13)10-11-22(3,28-21)29-30-23/h5-8,13-14,17-18,20-21H,4,9-12H2,1-3H3,(H,24,25)/t13-,14-,17+,18+,20+,21-,22-,23-/m1/s1

HIDE SMILES / InChI

Molecular Formula	C23H30O7
Molecular Weight	418.4801
Charge	0
Count

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

Approval Year

Substance Class	Chemical Created by `admin` on `Fri Dec 15 18:03:05 GMT 2023` Edited by `admin` on `Fri Dec 15 18:03:05 GMT 2023`
Record UNII	08X93406PG
Record Status	`Validated (UNII)`
Record Version

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Name

Type

Language

ARTELINIC ACID

Common Name

English

.BETA.-ARTELINIC ACID

Common Name

English

BENZOIC ACID, 4-((((3R,5AS,6R,8AS,9R,10S,12R,12AR)-DECAHYDRO-3,6,9-TRIMETHYL-3,12-EPOXY-12H-PYRANO(4,3-J)-1,2-BENZODIOXEPIN-10-YL)OXY)METHYL)-

Systematic Name

English

Code System Code Type Description

CAS

120020-26-0