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Details

Stereochemistry ABSOLUTE
Molecular Formula C35H60O2
Molecular Weight 512.8497
Optical Activity UNSPECIFIED
Defined Stereocenters 8 / 8
E/Z Centers 0
Charge 0

SHOW SMILES / InChI
Structure of CHOLESTERYL OCTANOATE

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@H](C)CCCC(C)C

InChI

InChIKey=SKLBBRQPVZDTNM-SJTWHRLHSA-N
InChI=1S/C35H60O2/c1-7-8-9-10-11-15-33(36)37-28-20-22-34(5)27(24-28)16-17-29-31-19-18-30(26(4)14-12-13-25(2)3)35(31,6)23-21-32(29)34/h16,25-26,28-32H,7-15,17-24H2,1-6H3/t26-,28+,29+,30-,31+,32+,34+,35-/m1/s1

HIDE SMILES / InChI

Molecular Formula C35H60O2
Molecular Weight 512.8497
Charge 0
Count
Stereochemistry ABSOLUTE
Additional Stereochemistry No
Defined Stereocenters 8 / 8
E/Z Centers 0
Optical Activity UNSPECIFIED

Approval Year

Substance Class Chemical
Created
by admin
on Sat Dec 16 12:20:21 GMT 2023
Edited
by admin
on Sat Dec 16 12:20:21 GMT 2023
Record UNII
X9U26HA4Z2
Record Status Validated (UNII)
Record Version
  • Download
Name Type Language
CHOLESTERYL OCTANOATE
Common Name English
CHOLESTEROL, OCTANOATE
Common Name English
3.BETA.-(OCTANOYLOXY)CHOLEST-5-ENE
Common Name English
CAPRYLIC ACID CHOLESTEROL ESTER
Common Name English
CHOLESTERYL CAPRYLATE [USP-RS]
Common Name English
CHOLEST-5-EN-3-OL (3.BETA.)-, OCTANOATE
Common Name English
5-CHOLESTEN-3.BETA.-OL CAPRYLATE
Common Name English
CHOLEST-5-EN-3-OL (3.BETA.)-, 3-OCTANOATE
Common Name English
Code System Code Type Description
EPA CompTox
DTXSID00152038
Created by admin on Sat Dec 16 12:20:21 GMT 2023 , Edited by admin on Sat Dec 16 12:20:21 GMT 2023
PRIMARY
ECHA (EC/EINECS)
214-656-2
Created by admin on Sat Dec 16 12:20:21 GMT 2023 , Edited by admin on Sat Dec 16 12:20:21 GMT 2023
PRIMARY
PUBCHEM
102015
Created by admin on Sat Dec 16 12:20:21 GMT 2023 , Edited by admin on Sat Dec 16 12:20:21 GMT 2023
PRIMARY
FDA UNII
X9U26HA4Z2
Created by admin on Sat Dec 16 12:20:21 GMT 2023 , Edited by admin on Sat Dec 16 12:20:21 GMT 2023
PRIMARY
RS_ITEM_NUM
1132001
Created by admin on Sat Dec 16 12:20:21 GMT 2023 , Edited by admin on Sat Dec 16 12:20:21 GMT 2023
PRIMARY
CAS
1182-42-9
Created by admin on Sat Dec 16 12:20:21 GMT 2023 , Edited by admin on Sat Dec 16 12:20:21 GMT 2023
PRIMARY