Glaucarubinone

Details

Stereochemistry	ABSOLUTE
Molecular Formula	C25H34O10
Molecular Weight	494.5315
Optical Activity	( + )
Defined Stereocenters	12 / 12
E/Z Centers	0
Charge	0

SHOW SMILES / InChI

Structure Search

SMILES

CC[C@](C)(O)C(=O)O[C@@H]1[C@H]2[C@@H](C)[C@@H](O)[C@@]3(O)OC[C@@]24[C@H]3[C@@]5(C)[C@H](O)C(=O)C=C(C)[C@@H]5C[C@H]4OC1=O

InChI

InChIKey=WRBGCYVAJRRQKP-STDAJNJZSA-N

InChI=1S/C25H34O10/c1-6-22(4,31)21(30)35-16-15-11(3)17(27)25(32)20-23(5)12(10(2)7-13(26)18(23)28)8-14(34-19(16)29)24(15,20)9-33-25/h7,11-12,14-18,20,27-28,31-32H,6,8-9H2,1-5H3/t11-,12+,14-,15-,16-,17-,18-,20-,22+,23-,24+,25+/m1/s1

HIDE SMILES / InChI

Molecular Formula	C25H34O10
Molecular Weight	494.5315
Charge	0
Count

Stereochemistry	ABSOLUTE
Additional Stereochemistry	No
Defined Stereocenters	12 / 12
E/Z Centers	0
Optical Activity	UNSPECIFIED

Approval Year

Substance Class	Chemical Created by `admin` on `Wed Apr 02 11:35:28 GMT 2025` Edited by `admin` on `Wed Apr 02 11:35:28 GMT 2025`
Record UNII	YVP3DCD53V
Record Status	`Validated (UNII)`
Record Version

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Name

Type

Language

NSC-132791

Preferred Name

English

Glaucarubinone

Common Name

English

Picras-3-ene-2,16-dione, 11,20-epoxy-1,11,12-trihydroxy-15-[(2S)-2-hydroxy-2-methyl-1-oxobutoxy]-, (1?,11?,12?,15?)-

Systematic Name

English

(+)-Glaucarubinone

Common Name

English

NSC-277286

Code

English

Code System Code Type Description

EPA CompTox

DTXSID201317402