CHONDRILLASTEROL BENZOATE

Details

Stereochemistry	ABSOLUTE
Molecular Formula	C36H52O2
Molecular Weight	516.7969
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])C3=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)\C=C\[C@H](CC)C(C)C

InChI

InChIKey=LGEUMKAYCYEGKB-XNSKUXCYSA-N

InChI=1S/C36H52O2/c1-7-26(24(2)3)14-13-25(4)31-17-18-32-30-16-15-28-23-29(38-34(37)27-11-9-8-10-12-27)19-21-35(28,5)33(30)20-22-36(31,32)6/h8-14,16,24-26,28-29,31-33H,7,15,17-23H2,1-6H3/b14-13+/t25-,26+,28+,29+,31-,32+,33+,35+,36-/m1/s1

HIDE SMILES / InChI

Molecular Formula	C36H52O2
Molecular Weight	516.7969
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 08:24:29 GMT 2023` Edited by `admin` on `Sat Dec 16 08:24:29 GMT 2023`
Record UNII	039S45723P
Record Status	`Validated (UNII)`
Record Version

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Name

Type

Language

CHONDRILLASTEROL BENZOATE

Common Name

English

CHONDRILLASTERYL BENZOATE

Common Name

English

STIGMASTA-7,22-DIEN-3-OL, BENZOATE, (3.BETA.,5.ALPHA.,22E,24R)-

Systematic Name

English

CHONDRILLASTEROL BENZOATE [MI]

Common Name

English

5.ALPHA.-STIGMASTA-7,22-DIEN-3.BETA.-OL, BENZOATE, (24R)-

Systematic Name

English

Code System Code Type Description

CAS

5808-19-5

Created by admin on Sat Dec 16 08:24:29 GMT 2023 , Edited by admin on Sat Dec 16 08:24:29 GMT 2023

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PUBCHEM

73425391

Created by admin on Sat Dec 16 08:24:29 GMT 2023 , Edited by admin on Sat Dec 16 08:24:29 GMT 2023

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FDA UNII

039S45723P

Created by admin on Sat Dec 16 08:24:29 GMT 2023 , Edited by admin on Sat Dec 16 08:24:29 GMT 2023

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MERCK INDEX

m3486

Created by admin on Sat Dec 16 08:24:29 GMT 2023 , Edited by admin on Sat Dec 16 08:24:29 GMT 2023

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Merck Index