Nigakilactone C

Details

Stereochemistry	ABSOLUTE
Molecular Formula	C24H34O7
Molecular Weight	434.5226
Optical Activity	UNSPECIFIED
Defined Stereocenters	10 / 10
E/Z Centers	0
Charge	0

SHOW SMILES / InChI

Structure Search

SMILES

CO[C@H]1[C@H](C)[C@@H]2CC(=O)O[C@@H]3C[C@H]4[C@H](C)C=C(OC)C(=O)[C@]4(C)[C@@H]([C@@H]1OC(C)=O)[C@]23C

InChI

InChIKey=JFFUKRBVELYCPJ-FIKFPIMESA-N

InChI=1S/C24H34O7/c1-11-8-16(28-6)22(27)24(5)14(11)9-17-23(4)15(10-18(26)31-17)12(2)19(29-7)20(21(23)24)30-13(3)25/h8,11-12,14-15,17,19-21H,9-10H2,1-7H3/t11-,12-,14+,15+,17-,19+,20-,21+,23-,24+/m1/s1

HIDE SMILES / InChI

Molecular Formula	C24H34O7
Molecular Weight	434.5226
Charge	0
Count

Stereochemistry	ABSOLUTE
Additional Stereochemistry	No
Defined Stereocenters	10 / 10
E/Z Centers	0
Optical Activity	UNSPECIFIED

Approval Year

Substance Class	Chemical Created by `admin` on `Mon Mar 31 22:24:24 GMT 2025` Edited by `admin` on `Mon Mar 31 22:24:24 GMT 2025`
Record UNII	QBP9GW28WH
Record Status	`Validated (UNII)`
Record Version

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Name

Type

Language

Nigakilactone C

Common Name

English

11?-Acetoxy-2,12?-Dimethoxypicras-2-Ene-1,16-Dione

Preferred Name

English

Phenanthro[10,1-bc]pyran-5,11(1H,4H)-dione, 2,3,3a?,6a?,7,7a?,8,11a,11b?,11c-decahydro-1?-hydroxy-2?,10-dimethoxy-3?,8?,11a?,11c?-tetramethyl-, acetate

Systematic Name

English

Picras-2-ene-1,16-dione, 11-(acetyloxy)-2,12-dimethoxy-, (11?,12?)-

Common Name

English

Nigakilactone

Common Name

English

Code System Code Type Description

CAS

24148-78-5

Created by admin on Mon Mar 31 22:24:24 GMT 2025 , Edited by admin on Mon Mar 31 22:24:24 GMT 2025

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EPA CompTox

DTXSID40946978

Created by admin on Mon Mar 31 22:24:24 GMT 2025 , Edited by admin on Mon Mar 31 22:24:24 GMT 2025

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PUBCHEM

185556

Created by admin on Mon Mar 31 22:24:24 GMT 2025 , Edited by admin on Mon Mar 31 22:24:24 GMT 2025

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FDA UNII

QBP9GW28WH

Created by admin on Mon Mar 31 22:24:24 GMT 2025 , Edited by admin on Mon Mar 31 22:24:24 GMT 2025

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