.ALPHA.-ERGOSTENOL BENZOATE

Details

Stereochemistry	ABSOLUTE
Molecular Formula	C35H52O2
Molecular Weight	504.7862
Optical Activity	UNSPECIFIED
Defined Stereocenters	8 / 8
E/Z Centers	0
Charge	0

SHOW SMILES / InChI

Structure of .ALPHA.-ERGOSTENOL BENZOATE

Structure Search

SMILES

[H][C@@]1(CCC2=C3CC[C@@]4([H])C[C@H](CC[C@]4(C)[C@@]3([H])CC[C@]12C)OC(=O)C5=CC=CC=C5)[C@H](C)CC[C@H](C)C(C)C

InChI

InChIKey=IOHGSXJQBQDGAE-OLCBBKHWSA-N

InChI=1S/C35H52O2/c1-23(2)24(3)12-13-25(4)30-16-17-31-29-15-14-27-22-28(37-33(36)26-10-8-7-9-11-26)18-20-34(27,5)32(29)19-21-35(30,31)6/h7-11,23-25,27-28,30,32H,12-22H2,1-6H3/t24-,25+,27-,28-,30+,32-,34-,35+/m0/s1

HIDE SMILES / InChI

Molecular Formula	C35H52O2
Molecular Weight	504.7862
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 10:01:25 GMT 2023` Edited by `admin` on `Sat Dec 16 10:01:25 GMT 2023`
Record UNII	4HWQ88O5UA
Record Status	`Validated (UNII)`
Record Version

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Name

Type

Language

.ALPHA.-ERGOSTENOL BENZOATE

Common Name

English

5.ALPHA.-ERGOST-8(14)-EN-3.BETA.-OL, BENZOATE

Systematic Name

English

.ALPHA.-ERGOSTENOL BENZOATE [MI]

Common Name

English

(3.BETA.,5.ALPHA.)-ERGOST-8(14)-EN-3-OL, BENZOATE

Systematic Name

English

ERGOST-8(14)-EN-3-OL, BENZOATE, (3.BETA.,5.ALPHA.)-

Systematic Name

English

Code System Code Type Description

CAS

6055-59-0

Created by admin on Sat Dec 16 10:01:25 GMT 2023 , Edited by admin on Sat Dec 16 10:01:25 GMT 2023

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FDA UNII

4HWQ88O5UA

Created by admin on Sat Dec 16 10:01:25 GMT 2023 , Edited by admin on Sat Dec 16 10:01:25 GMT 2023

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MERCK INDEX

m719

Created by admin on Sat Dec 16 10:01:25 GMT 2023 , Edited by admin on Sat Dec 16 10:01:25 GMT 2023

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Merck Index

PUBCHEM

91617908

Created by admin on Sat Dec 16 10:01:25 GMT 2023 , Edited by admin on Sat Dec 16 10:01:25 GMT 2023

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