AKEBONOIC ACID

Details

Stereochemistry	ABSOLUTE
Molecular Formula	C29H44O3
Molecular Weight	440.6579
Optical Activity	UNSPECIFIED
Defined Stereocenters	8 / 8
E/Z Centers	0
Charge	0

SHOW SMILES / InChI

Structure Search

SMILES

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

InChI

InChIKey=XWVVPZWKCNXREE-VSQYQUPVSA-N

InChI=1S/C29H44O3/c1-18-9-14-29(24(31)32)16-15-27(5)19(20(29)17-18)7-8-22-26(4)12-11-23(30)25(2,3)21(26)10-13-28(22,27)6/h7,20-23,30H,1,8-17H2,2-6H3,(H,31,32)/t20-,21-,22+,23-,26-,27+,28+,29-/m0/s1

HIDE SMILES / InChI

Molecular Formula	C29H44O3
Molecular Weight	440.6579
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 16:07:48 GMT 2023` Edited by `admin` on `Fri Dec 15 16:07:48 GMT 2023`
Record UNII	FG4NSA90TQ
Record Status	`Validated (UNII)`
Record Version

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Name

Type

Language

AKEBONOIC ACID

Common Name

English

4A(2H)-PICENECARBOXYLIC ACID, 1,3,4,5,6,6A,6B,7,8,8A,9,10,11,12,12A,12B,13,14B-OCTADECAHYDRO-10-HYDROXY-6A,6B,9,9,12A-PENTAMETHYL-2-METHYLENE-, (4AS,6AS,6BR,8AR,10S,12AR,12BR,14BS)-

Systematic Name

English

AKEBONIC ACID

Common Name

English

30-NOROLEANA-12,20(29)-DIEN-28-OIC ACID, 3-HYDROXY-, (3.BETA.)-

Systematic Name

English

Code System Code Type Description

CAS

104777-60-8

Created by admin on Fri Dec 15 16:07:48 GMT 2023 , Edited by admin on Fri Dec 15 16:07:48 GMT 2023

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FDA UNII

FG4NSA90TQ

Created by admin on Fri Dec 15 16:07:48 GMT 2023 , Edited by admin on Fri Dec 15 16:07:48 GMT 2023

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PUBCHEM

14036559

Created by admin on Fri Dec 15 16:07:48 GMT 2023 , Edited by admin on Fri Dec 15 16:07:48 GMT 2023

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