PENTAERYTHRITYL ISOPIMARATE

Details

Stereochemistry	ABSOLUTE
Molecular Formula	C25H40O5
Molecular Weight	420.5821
Optical Activity	UNSPECIFIED
Defined Stereocenters	5 / 5
E/Z Centers	0
Charge	0

SHOW SMILES / InChI

Structure of PENTAERYTHRITYL ISOPIMARATE

Structure Search

SMILES

C[C@@]1(CC[C@H]2C(C1)=CC[C@@H]3[C@]2(C)CCC[C@@]3(C)C(=O)OCC(CO)(CO)CO)C=C

InChI

InChIKey=UTBUEDJTXCFKOE-VQPDEGQRSA-N

InChI=1S/C25H40O5/c1-5-22(2)12-9-19-18(13-22)7-8-20-23(19,3)10-6-11-24(20,4)21(29)30-17-25(14-26,15-27)16-28/h5,7,19-20,26-28H,1,6,8-17H2,2-4H3/t19-,20+,22-,23+,24+/m0/s1

HIDE SMILES / InChI

Molecular Formula	C25H40O5
Molecular Weight	420.5821
Charge	0
Count

Stereochemistry	ABSOLUTE
Additional Stereochemistry	No
Defined Stereocenters	5 / 5
E/Z Centers	0
Optical Activity	UNSPECIFIED

Approval Year

Substance Class	Chemical Created by `admin` on `Mon Mar 31 22:05:37 GMT 2025` Edited by `admin` on `Mon Mar 31 22:05:37 GMT 2025`
Record UNII	IM669AYD0A
Record Status	`Validated (UNII)`
Record Version

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Name

Type

Language

PENTAERYTHRITYL ISOPIMARATE

Common Name

English

PENTAERYTHRITOL ISOPIMARATE

Preferred Name

English

(3-HYDROXY-2,2-BIS(HYDROXYMETHYL)PROPYL) (1R,4AR,4BS,7S,10AR)-1,4A,7-TRIMETHYL-7-VINYL-3,4,4B,5,6,8,10,10A-OCTAHYDRO-2H-PHENANTHRENE-1-CARBOXYLATE

Systematic Name

English

Code System Code Type Description

PUBCHEM

76967244

Created by admin on Mon Mar 31 22:05:37 GMT 2025 , Edited by admin on Mon Mar 31 22:05:37 GMT 2025

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FDA UNII

IM669AYD0A

Created by admin on Mon Mar 31 22:05:37 GMT 2025 , Edited by admin on Mon Mar 31 22:05:37 GMT 2025

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