SONOLISIB

Details

Stereochemistry	ABSOLUTE
Molecular Formula	C29H35NO8
Molecular Weight	525.5901
Optical Activity	UNSPECIFIED
Defined Stereocenters	5 / 5
E/Z Centers	1
Charge	0

SHOW SMILES / InChI

Structure Search

SMILES

[H][C@@]12CCC(=O)[C@@]1(C)C[C@@H](OC(C)=O)C3=C2C(=O)C(O)=C4\C(=C/N(CC=C)CC=C)C(=O)O[C@H](COC)[C@]34C

InChI

InChIKey=QIUASFSNWYMDFS-NILGECQDSA-N

InChI=1S/C29H35NO8/c1-7-11-30(12-8-2)14-17-23-26(34)25(33)22-18-9-10-20(32)28(18,4)13-19(37-16(3)31)24(22)29(23,5)21(15-36-6)38-27(17)35/h7-8,14,18-19,21,34H,1-2,9-13,15H2,3-6H3/b17-14+/t18-,19+,21+,28-,29-/m0/s1

HIDE SMILES / InChI

Molecular Formula	C29H35NO8
Molecular Weight	525.5901
Charge	0
Count

Stereochemistry	ABSOLUTE
Additional Stereochemistry	No
Defined Stereocenters	5 / 5
E/Z Centers	1
Optical Activity	UNSPECIFIED

Approval Year

Substance Class	Chemical Created by `admin` on `Sat Dec 16 17:38:13 UTC 2023` Edited by `admin` on `Sat Dec 16 17:38:13 UTC 2023`
Record UNII	987796874T
Record Status	`Validated (UNII)`
Record Version

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Name

Type

Language

SONOLISIB

Official Name

English

sonolisib [INN]

Common Name

English

PX-866

Code

English

(4E)-4-(((BIS(PROP-2-EN-1-YL)AMINO)METHYLIDENE)-6-HYDROXY-1.ALPHA.-(METHOXYMETHYL)-3,7,17-TRIOXO-2-OXAANDROSTA-5,8-DIEN-11.ALPHA.-YL ACETATE

Common Name

English

CYCLOPENTA(5,6)NAPHTHO(1,2-C)PYRAN-2,7,10(1H)-TRIONE, 5-(ACETYLOXY)-1-((DI-2-PROPEN-1-YLAMINO)METHYLENE)-4,4A,5,6,6A,8,9,9A-OCTAHYDRO-11-HYDROXY-4-(METHOXYMETHYL)-4A,6A-DIMETHYL-, (1E,4S,4AR,5R,6AS,9AR)-

Common Name

English

Sonolisib [WHO-DD]

Common Name

English

Classification Tree Code System Code

NCI_THESAURUS

C129825