STYPOLDIONE

Details

Stereochemistry	ABSOLUTE
Molecular Formula	C27H38O4
Molecular Weight	426.5882
Optical Activity	( - )
Defined Stereocenters	7 / 7
E/Z Centers	0
Charge	0

SHOW SMILES / InChI

Structure Search

SMILES

[H][C@@]12CC[C@]3(C)[C@]([H])(CC[C@H](C)[C@@]34CC5=C(O4)C(C)=CC(=O)C5=O)[C@@]1(C)CC[C@H](O)C2(C)C

InChI

InChIKey=LLWMPGSQZXZZAE-JZFVXYNCSA-N

InChI=1S/C27H38O4/c1-15-13-18(28)22(30)17-14-27(31-23(15)17)16(2)7-8-20-25(5)11-10-21(29)24(3,4)19(25)9-12-26(20,27)6/h13,16,19-21,29H,7-12,14H2,1-6H3/t16-,19-,20+,21-,25-,26+,27-/m0/s1

HIDE SMILES / InChI

Molecular Formula	C27H38O4
Molecular Weight	426.5882
Charge	0
Count

Stereochemistry	ABSOLUTE
Additional Stereochemistry	No
Defined Stereocenters	7 / 7
E/Z Centers	0
Optical Activity	UNSPECIFIED

Approval Year

Substance Class	Chemical Created by `admin` on `Fri Dec 15 19:46:57 GMT 2023` Edited by `admin` on `Fri Dec 15 19:46:57 GMT 2023`
Record UNII	Y7JZ2J63Q7
Record Status	`Validated (UNII)`
Record Version

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Name

Type

Language

STYPOLDIONE

Common Name

English

NSC-339672

Code

English

Spiro[benzofuran-2(3H),1′(2′H)-phenanthrene]-4,5-dione, 3′,4′,4′a,4′b,5′,6′,7′,8′,8′a,9′,10′,10′a-dodecahydro-7′-hydroxy-2′,4′b,7,8′,8′,10′a-hexamethyl-, (1′S,2′S,4′aR,4′bS,7′S,8′aR,10′aR)-

Systematic Name

English

Code System Code Type Description

PUBCHEM

3034636