.BETA.-ERGOSTENOL BENZOATE

Details

Stereochemistry	ABSOLUTE
Molecular Formula	C35H52O2
Molecular Weight	504.7862
Optical Activity	UNSPECIFIED
Defined Stereocenters	9 / 9
E/Z Centers	0
Charge	0

SHOW SMILES / InChI

Structure Search

SMILES

[H][C@@]1(CC=C2[C@]3([H])CC[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=PXRZGKIPOGDNPV-ABMSVMQMSA-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/h7-11,17,23-25,27-30,32H,12-16,18-22H2,1-6H3/t24-,25+,27-,28-,29-,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	9 / 9
E/Z Centers	0
Optical Activity	UNSPECIFIED

Approval Year

Substance Class	Chemical Created by `admin` on `Sat Dec 16 09:44:27 GMT 2023` Edited by `admin` on `Sat Dec 16 09:44:27 GMT 2023`
Record UNII	DGT82PX37S
Record Status	`Validated (UNII)`
Record Version

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Name

Type

Language

.BETA.-ERGOSTENOL BENZOATE

Common Name

English

.BETA.-ERGOSTENOL BENZOATE [MI]

Common Name

English

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

Systematic Name

English

Code System Code Type Description

MERCK INDEX

m720

Created by admin on Sat Dec 16 09:44:27 GMT 2023 , Edited by admin on Sat Dec 16 09:44:27 GMT 2023

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Merck Index

CAS

6034-20-4

Created by admin on Sat Dec 16 09:44:27 GMT 2023 , Edited by admin on Sat Dec 16 09:44:27 GMT 2023

PRIMARY

PUBCHEM

91618105

Created by admin on Sat Dec 16 09:44:27 GMT 2023 , Edited by admin on Sat Dec 16 09:44:27 GMT 2023

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FDA UNII

DGT82PX37S

Created by admin on Sat Dec 16 09:44:27 GMT 2023 , Edited by admin on Sat Dec 16 09:44:27 GMT 2023

PRIMARY