ARNICOLIDE B

Details

Stereochemistry	ABSOLUTE
Molecular Formula	C20H28O5
Molecular Weight	348.4333
Optical Activity	UNSPECIFIED
Defined Stereocenters	7 / 7
E/Z Centers	0
Charge	0

SHOW SMILES / InChI

Structure Search

SMILES

CC(C)CC(=O)O[C@H]1[C@H]2[C@@H](C[C@@H](C)[C@@H]3C=CC(=O)[C@@]13C)OC(=O)[C@H]2C

InChI

InChIKey=XOSUIROVCFABAY-QUQQNCTQSA-N

InChI=1S/C20H28O5/c1-10(2)8-16(22)25-18-17-12(4)19(23)24-14(17)9-11(3)13-6-7-15(21)20(13,18)5/h6-7,10-14,17-18H,8-9H2,1-5H3/t11-,12+,13+,14-,17-,18+,20+/m1/s1

HIDE SMILES / InChI

Molecular Formula	C20H28O5
Molecular Weight	348.4333
Charge	0
Count

Stereochemistry	ABSOLUTE
Additional Stereochemistry	No
Defined Stereocenters	7 / 7
E/Z Centers	0
Optical Activity	UNSPECIFIED

Approval Year

Substance Class	Chemical Created by `admin` on `Mon Mar 31 22:40:23 GMT 2025` Edited by `admin` on `Mon Mar 31 22:40:23 GMT 2025`
Record UNII	PTH3RMN3NS
Record Status	`Validated (UNII)`
Record Version

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Name

Type

Language

11,13-DIHYDROHELENALIN ISOVALERATE

Preferred Name

English

ARNICOLIDE B

Common Name

English

BUTANOIC ACID, 3-METHYL-, (3S,3AR,4S,4AR,7AR,8R,9AR)-2,3,3A,4,4A,5,7A,8,9,9A-DECAHYDRO-3,4A,8-TRIMETHYL-2,5-DIOXOAZULENO(6,5-B)FURAN-4-YL ESTER

Systematic Name

English

((1S,3AR,5R,5AR,8AR,9S,9AR)-1,5,8A-TRIMETHYL-2,8-DIOXO-3A,4,5,5A,9,9A-HEXAHYDRO-1H-AZULENO(6,5-B)FURAN-9-YL) 3-METHYLBUTANOATE

Systematic Name

English

FLEXUOSIN B, ANHYDRODIHYDRO-

Common Name

English

(3S,3AR,4S,4AR,7AR,8R,9AR)-3,4A,8-TRIMETHYL-2,5-DIOXO-2H,3H,3AH,4H,4AH,5H,7AH,8H,9H,9AH-AZULENO(6,5-B)FURAN-4-YL 3-METHYLBUTANOATE

Systematic Name

English

AMBROS-2-EN-12-OIC ACID, 6.ALPHA.,8.BETA.-DIHYDROXY-4-OXO-, 12,8-LACTONE, ISOVALERATE, (11S)-

Systematic Name

English

Code System Code Type Description

CAS

34532-66-6

Created by admin on Mon Mar 31 22:40:23 GMT 2025 , Edited by admin on Mon Mar 31 22:40:23 GMT 2025

PRIMARY

PUBCHEM

14656908

Created by admin on Mon Mar 31 22:40:23 GMT 2025 , Edited by admin on Mon Mar 31 22:40:23 GMT 2025

PRIMARY

FDA UNII

PTH3RMN3NS

Created by admin on Mon Mar 31 22:40:23 GMT 2025 , Edited by admin on Mon Mar 31 22:40:23 GMT 2025

PRIMARY

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