CAMPESTERYL OLEATE

Details

Stereochemistry	ABSOLUTE
Molecular Formula	C46H80O2
Molecular Weight	665.1262
Optical Activity	UNSPECIFIED
Defined Stereocenters	9 / 9
E/Z Centers	1
Charge	0

SHOW SMILES / InChI

Structure Search

SMILES

[H][C@@]1(CC[C@@]2([H])[C@]3([H])CC=C4C[C@H](CC[C@]4(C)[C@@]3([H])CC[C@]12C)OC(=O)CCCCCCC\C=C/CCCCCCCC)[C@H](C)CC[C@@H](C)C(C)C

InChI

InChIKey=PBJGXWXGARTUCF-TVTZIXCTSA-N

InChI=1S/C46H80O2/c1-8-9-10-11-12-13-14-15-16-17-18-19-20-21-22-23-44(47)48-39-30-32-45(6)38(34-39)26-27-40-42-29-28-41(46(42,7)33-31-43(40)45)37(5)25-24-36(4)35(2)3/h15-16,26,35-37,39-43H,8-14,17-25,27-34H2,1-7H3/b16-15-/t36-,37-,39+,40+,41-,42+,43+,45+,46-/m1/s1

HIDE SMILES / InChI

Molecular Formula	C46H80O2
Molecular Weight	665.1262
Charge	0
Count

Stereochemistry	ABSOLUTE
Additional Stereochemistry	No
Defined Stereocenters	9 / 9
E/Z Centers	1
Optical Activity	UNSPECIFIED

Approval Year

Substance Class	Chemical Created by `admin` on `Sat Dec 16 15:19:13 GMT 2023` Edited by `admin` on `Sat Dec 16 15:19:13 GMT 2023`
Record UNII	N67NFU75QY
Record Status	`Validated (UNII)`
Record Version

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Name

Type

Language

CAMPESTERYL OLEATE

Common Name

English

ERGOST-5-EN-3-OL, 3-((9Z)-9-OCTADECENOATE), (3.BETA.,24R)-

Systematic Name

English

Code System Code Type Description

FDA UNII

N67NFU75QY

Created by admin on Sat Dec 16 15:19:13 GMT 2023 , Edited by admin on Sat Dec 16 15:19:13 GMT 2023

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CAS

64144-49-6

Created by admin on Sat Dec 16 15:19:13 GMT 2023 , Edited by admin on Sat Dec 16 15:19:13 GMT 2023

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EPA CompTox

DTXSID501315986

Created by admin on Sat Dec 16 15:19:13 GMT 2023 , Edited by admin on Sat Dec 16 15:19:13 GMT 2023

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PUBCHEM

69167708

Created by admin on Sat Dec 16 15:19:13 GMT 2023 , Edited by admin on Sat Dec 16 15:19:13 GMT 2023

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