SHELLOLIC ACID

Details

Stereochemistry	ABSOLUTE
Molecular Formula	C15H20O6
Molecular Weight	296.3157
Optical Activity	UNSPECIFIED
Defined Stereocenters	6 / 6
E/Z Centers	0
Charge	0

SHOW SMILES / InChI

Structure Search

SMILES

C[C@@]1(CO)[C@H]2C[C@]3([C@@H](CC[C@@H]13)C(O)=O)[C@@H](O)C=C2C(O)=O

InChI

InChIKey=WSASFFHWOQGSER-MUAIWGBPSA-N

InChI=1S/C15H20O6/c1-14(6-16)9-5-15(11(17)4-7(9)12(18)19)8(13(20)21)2-3-10(14)15/h4,8-11,16-17H,2-3,5-6H2,1H3,(H,18,19)(H,20,21)/t8-,9-,10-,11-,14+,15+/m0/s1

HIDE SMILES / InChI

Molecular Formula	C15H20O6
Molecular Weight	296.3157
Charge	0
Count

Stereochemistry	ABSOLUTE
Additional Stereochemistry	No
Defined Stereocenters	6 / 6
E/Z Centers	0
Optical Activity	UNSPECIFIED

Approval Year

Patents

Substance Class	Chemical Created by `admin` on `Wed Apr 02 11:33:19 GMT 2025` Edited by `admin` on `Wed Apr 02 11:33:19 GMT 2025`
Record UNII	82XGF31Q2Y
Record Status	`Validated (UNII)`
Record Version

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Name

Type

Language

SHELLOLIC ACID

Common Name

English

10.BETA.,13-DIHYDROXYCEDR-8-ENE-12,15-DIOIC ACID

Preferred Name

English

SHELLOLIC ACID [MI]

Common Name

English

1H-3A,7-METHANOAZULENE-3,6-DICARBOXYLIC ACID, 2,3,4,7,8,8A-HEXAHYDRO-4-HYDROXY-8-(HYDROXYMETHYL)-8-METHYL-, (3R,3AS,4S,7R,8S,8AS)-

Systematic Name

English

Code System Code Type Description

MERCK INDEX

m9888

Created by admin on Wed Apr 02 11:33:19 GMT 2025 , Edited by admin on Wed Apr 02 11:33:19 GMT 2025

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Merck Index

CAS

4448-95-7

Created by admin on Wed Apr 02 11:33:19 GMT 2025 , Edited by admin on Wed Apr 02 11:33:19 GMT 2025

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FDA UNII

82XGF31Q2Y

Created by admin on Wed Apr 02 11:33:19 GMT 2025 , Edited by admin on Wed Apr 02 11:33:19 GMT 2025

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PUBCHEM

20055026

Created by admin on Wed Apr 02 11:33:19 GMT 2025 , Edited by admin on Wed Apr 02 11:33:19 GMT 2025

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