STEARYL COENZYME A

Details

Stereochemistry	ABSOLUTE
Molecular Formula	C39H70N7O17P3S
Molecular Weight	1033.996
Optical Activity	UNSPECIFIED
Defined Stereocenters	5 / 5
E/Z Centers	0
Charge	0

SHOW SMILES / InChI

Structure Search

SMILES

CCCCCCCCCCCCCCCCCC(=O)SCCNC(=O)CCNC(=O)[C@H](O)C(C)(C)COP(O)(=O)OP(O)(=O)OC[C@H]1O[C@H]([C@H](O)[C@@H]1OP(O)(O)=O)N2C=NC3=C2N=CN=C3N

InChI

InChIKey=SIARJEKBADXQJG-LFZQUHGESA-N

InChI=1S/C39H70N7O17P3S/c1-4-5-6-7-8-9-10-11-12-13-14-15-16-17-18-19-30(48)67-23-22-41-29(47)20-21-42-37(51)34(50)39(2,3)25-60-66(57,58)63-65(55,56)59-24-28-33(62-64(52,53)54)32(49)38(61-28)46-27-45-31-35(40)43-26-44-36(31)46/h26-28,32-34,38,49-50H,4-25H2,1-3H3,(H,41,47)(H,42,51)(H,55,56)(H,57,58)(H2,40,43,44)(H2,52,53,54)/t28-,32-,33-,34+,38-/m1/s1

HIDE SMILES / InChI

Molecular Formula	C39H70N7O17P3S
Molecular Weight	1033.996
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 `Sat Dec 16 08:24:57 GMT 2023` Edited by `admin` on `Sat Dec 16 08:24:57 GMT 2023`
Record UNII	OBC49BV194
Record Status	`Validated (UNII)`
Record Version

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Name

Type

Language

STEARYL COENZYME A

Common Name

English

STEARYL-COA

Systematic Name

English

OCTADECANOYL-COA

Systematic Name

English

STEAROYL COENZYME A ESTER

Systematic Name

English

OCTADECANOYL-COENZYME A

Systematic Name

English

STEAROYL COENZYME A

Systematic Name

English

STEAROYL-COA

Systematic Name

English

COENZYME A, S-STEARATE

Systematic Name

English

COENZYME A, S-OCTADECANOATE

Systematic Name

English

Code System Code Type Description

PUBCHEM

94140