Oleanonic acid

Details

Stereochemistry	ABSOLUTE
Molecular Formula	C30H46O3
Molecular Weight	454.6844
Optical Activity	( + )
Defined Stereocenters	7 / 7
E/Z Centers	0
Charge	0

SHOW SMILES / InChI

Structure Search

SMILES

CC1(C)CC[C@@]2(CC[C@]3(C)C(=CC[C@@H]4[C@@]5(C)CCC(=O)C(C)(C)[C@@H]5CC[C@@]34C)[C@@H]2C1)C(O)=O

InChI

InChIKey=FMIMFCRXYXVFTA-FUAOEXFOSA-N

InChI=1S/C30H46O3/c1-25(2)14-16-30(24(32)33)17-15-28(6)19(20(30)18-25)8-9-22-27(5)12-11-23(31)26(3,4)21(27)10-13-29(22,28)7/h8,20-22H,9-18H2,1-7H3,(H,32,33)/t20-,21-,22+,27-,28+,29+,30-/m0/s1

HIDE SMILES / InChI

Molecular Formula	C30H46O3
Molecular Weight	454.6844
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 `Tue Apr 01 22:05:28 GMT 2025` Edited by `admin` on `Tue Apr 01 22:05:28 GMT 2025`
Record UNII	JV79HC9A5B
Record Status	`Validated (UNII)`
Record Version

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Name

Type

Language

Oleanonic acid

Common Name

English

BLE-99006

Preferred Name

English

3-Oxooleanolic acid

Systematic Name

English

STX-50

Code

English

3-Ketooleanolic acid

Systematic Name

English

3-Oxoolean-12-en-28-oic acid

Systematic Name

English

Olean-12-en-28-oic acid, 3-oxo-

Systematic Name

English

Code System Code Type Description

PUBCHEM

12313704

Created by admin on Tue Apr 01 22:05:28 GMT 2025 , Edited by admin on Tue Apr 01 22:05:28 GMT 2025

PRIMARY

EPA CompTox

DTXSID90939279

Created by admin on Tue Apr 01 22:05:28 GMT 2025 , Edited by admin on Tue Apr 01 22:05:28 GMT 2025

PRIMARY

FDA UNII

JV79HC9A5B

Created by admin on Tue Apr 01 22:05:28 GMT 2025 , Edited by admin on Tue Apr 01 22:05:28 GMT 2025

PRIMARY

CAS

17990-42-0

Created by admin on Tue Apr 01 22:05:28 GMT 2025 , Edited by admin on Tue Apr 01 22:05:28 GMT 2025

PRIMARY

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