STIGMASTERYL FERULATE

Details

Stereochemistry	ABSOLUTE
Molecular Formula	C39H56O4
Molecular Weight	588.8595
Optical Activity	UNSPECIFIED
Defined Stereocenters	9 / 9
E/Z Centers	2
Charge	0

SHOW SMILES / InChI

Structure Search

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)\C=C\C5=CC(OC)=C(O)C=C5)[C@H](C)\C=C\[C@@H](CC)C(C)C

InChI

InChIKey=NMWHNQAIHFWROQ-ZJNYQSGUSA-N

InChI=1S/C39H56O4/c1-8-28(25(2)3)12-9-26(4)32-15-16-33-31-14-13-29-24-30(19-21-38(29,5)34(31)20-22-39(32,33)6)43-37(41)18-11-27-10-17-35(40)36(23-27)42-7/h9-13,17-18,23,25-26,28,30-34,40H,8,14-16,19-22,24H2,1-7H3/b12-9+,18-11+/t26-,28-,30+,31+,32-,33+,34+,38+,39-/m1/s1

HIDE SMILES / InChI

Molecular Formula	C39H56O4
Molecular Weight	588.8595
Charge	0
Count

Stereochemistry	ABSOLUTE
Additional Stereochemistry	No
Defined Stereocenters	9 / 9
E/Z Centers	2
Optical Activity	UNSPECIFIED

Approval Year

Substance Class	Chemical Created by `admin` on `Sat Dec 16 09:37:14 UTC 2023` Edited by `admin` on `Sat Dec 16 09:37:14 UTC 2023`
Record UNII	2560PXB85N
Record Status	`Validated (UNII)`
Record Version

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Name

Type

Language

STIGMASTERYL FERULATE

Common Name

English

STIGMASTEROL FERULATE

Common Name

English

STIGMASTA-5,22-DIEN-3-OL, 3-(3-(4-HYDROXY-3-METHOXYPHENYL)-2-PROPENOATE), (3.BETA.,22E)-

Systematic Name

English

CINNAMIC ACID, 4-HYDROXY-3-METHOXY-STIGMASTA-5,22-DIEN-3.BETA.-YL ESTER

Common Name

English

STIGMASTEROL, 4-HYDROXY-3-METHOXYCINNAMATE

Systematic Name

English

Code System Code Type Description

FDA UNII

2560PXB85N

Created by admin on Sat Dec 16 09:37:14 UTC 2023 , Edited by admin on Sat Dec 16 09:37:14 UTC 2023

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CAS

20972-08-1

Created by admin on Sat Dec 16 09:37:14 UTC 2023 , Edited by admin on Sat Dec 16 09:37:14 UTC 2023

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PUBCHEM

15056831

Created by admin on Sat Dec 16 09:37:14 UTC 2023 , Edited by admin on Sat Dec 16 09:37:14 UTC 2023

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