18.ALPHA.-OLEAN-12-ENE-3.BETA.,23,28-TRIOL

Details

Stereochemistry	ABSOLUTE
Molecular Formula	C30H50O3
Molecular Weight	458.7162
Optical Activity	UNSPECIFIED
Defined Stereocenters	9 / 9
E/Z Centers	0
Charge	0

SHOW SMILES / InChI

Structure of 18.ALPHA.-OLEAN-12-ENE-3.BETA.,23,28-TRIOL

Structure Search

SMILES

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

InChI

InChIKey=GGJRJQAJVMFZIP-FVAJCNFZSA-N

InChI=1S/C30H50O3/c1-25(2)13-15-30(19-32)16-14-28(5)20(21(30)17-25)7-8-23-26(3)11-10-24(33)27(4,18-31)22(26)9-12-29(23,28)6/h7,21-24,31-33H,8-19H2,1-6H3/t21-,22-,23-,24+,26+,27+,28-,29-,30-/m1/s1

HIDE SMILES / InChI

Molecular Formula	C30H50O3
Molecular Weight	458.7162
Charge	0
Count

Stereochemistry	ABSOLUTE
Additional Stereochemistry	No
Defined Stereocenters	9 / 9
E/Z Centers	0
Optical Activity	UNSPECIFIED

Approval Year

Substance Class	Chemical Created by `admin` on `Sat Dec 16 08:55:47 GMT 2023` Edited by `admin` on `Sat Dec 16 08:55:47 GMT 2023`
Record UNII	6ZBJ7WZ37B
Record Status	`Validated (UNII)`
Record Version

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Name

Type

Language

18.ALPHA.-OLEAN-12-ENE-3.BETA.,23,28-TRIOL

Common Name

English

18ALPHA-OLEAN-12-ENE-3BETA-23,28-TRIOL

Common Name

English

OLEAN-12-ENE-3,23,28-TRIOL, (3.BETA.,4.ALPHA.,18.ALPHA.)-

Systematic Name

English

Code System Code Type Description

FDA UNII

6ZBJ7WZ37B

Created by admin on Sat Dec 16 08:55:47 GMT 2023 , Edited by admin on Sat Dec 16 08:55:47 GMT 2023

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PUBCHEM

121225494

Created by admin on Sat Dec 16 08:55:47 GMT 2023 , Edited by admin on Sat Dec 16 08:55:47 GMT 2023

PRIMARY

CAS

117773-94-1

Created by admin on Sat Dec 16 08:55:47 GMT 2023 , Edited by admin on Sat Dec 16 08:55:47 GMT 2023

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EPA CompTox

DTXSID50922541

Created by admin on Sat Dec 16 08:55:47 GMT 2023 , Edited by admin on Sat Dec 16 08:55:47 GMT 2023

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