PENTAERYTHRITYL MONONEOABIETATE

Details

Stereochemistry	ABSOLUTE
Molecular Formula	C25H40O5
Molecular Weight	420.5821
Optical Activity	UNSPECIFIED
Defined Stereocenters	4 / 4
E/Z Centers	0
Charge	0

SHOW SMILES / InChI

Structure of PENTAERYTHRITYL MONONEOABIETATE

Structure Search

SMILES

[H][C@]12CCC(C=C1CC[C@@]3([H])[C@@](C)(CCC[C@]23C)C(=O)OCC(CO)(CO)CO)=C(C)C

InChI

InChIKey=YZGXOSMADMTBII-XWVZOOPGSA-N

InChI=1S/C25H40O5/c1-17(2)18-6-8-20-19(12-18)7-9-21-23(20,3)10-5-11-24(21,4)22(29)30-16-25(13-26,14-27)15-28/h12,20-21,26-28H,5-11,13-16H2,1-4H3/t20-,21+,23+,24+/m0/s1

HIDE SMILES / InChI

Molecular Formula	C25H40O5
Molecular Weight	420.5821
Charge	0
Count

Stereochemistry	ABSOLUTE
Additional Stereochemistry	No
Defined Stereocenters	4 / 4
E/Z Centers	0
Optical Activity	UNSPECIFIED

Approval Year

Substance Class	Chemical Created by `admin` on `Sat Dec 16 08:27:05 GMT 2023` Edited by `admin` on `Sat Dec 16 08:27:05 GMT 2023`
Record UNII	5X02836QQ1
Record Status	`Validated (UNII)`
Record Version

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Name

Type

Language

PENTAERYTHRITYL MONONEOABIETATE

Common Name

English

PENTAERYTHRITOL NEOABIETATE

Common Name

English

PENTAERYTHRITYL NEOABIETATE

Common Name

English

1-PHENANTHRENECARBOXYLIC ACID, 1,2,3,4,4A,4B,5,6,7,9,10,10A-DODECAHYDRO-1,4A-DIMETHYL-7-(1-METHYLETHYLIDENE)-, 3-HYDROXY-2,2-BIS(HYDROXYMETHYL)PROPYL ESTER, (1R,4AR,4BS,10AR)-

Systematic Name

English

Code System Code Type Description

CAS

906353-72-8

Created by admin on Sat Dec 16 08:27:05 GMT 2023 , Edited by admin on Sat Dec 16 08:27:05 GMT 2023

NON-SPECIFIC STEREOCHEMISTRY

PUBCHEM

72941944

Created by admin on Sat Dec 16 08:27:05 GMT 2023 , Edited by admin on Sat Dec 16 08:27:05 GMT 2023

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FDA UNII

5X02836QQ1

Created by admin on Sat Dec 16 08:27:05 GMT 2023 , Edited by admin on Sat Dec 16 08:27:05 GMT 2023

PRIMARY