SILVESTROL

Details

Stereochemistry	ABSOLUTE
Molecular Formula	C34H38O13
Molecular Weight	654.6577
Optical Activity	( - )
Defined Stereocenters	9 / 9
E/Z Centers	0
Charge	0

SHOW SMILES / InChI

Structure Search

SMILES

[H][C@]1([C@H]([C@@H](O)[C@@]2(O)C3=C(OC)C=C(O[C@@H]4O[C@]([H])(CO[C@H]4OC)[C@H](O)CO)C=C3O[C@@]12C5=CC=C(OC)C=C5)C(=O)OC)C6=CC=CC=C6

InChI

InChIKey=GVKXFVCXBFGBCD-QKDMMWSPSA-N

InChI=1S/C34H38O13/c1-40-20-12-10-19(11-13-20)34-27(18-8-6-5-7-9-18)26(30(38)42-3)29(37)33(34,39)28-23(41-2)14-21(15-24(28)47-34)45-32-31(43-4)44-17-25(46-32)22(36)16-35/h5-15,22,25-27,29,31-32,35-37,39H,16-17H2,1-4H3/t22-,25-,26-,27-,29-,31-,32-,33+,34+/m1/s1

HIDE SMILES / InChI

Molecular Formula	C34H38O13
Molecular Weight	654.6577
Charge	0
Count

Stereochemistry	ABSOLUTE
Additional Stereochemistry	No
Defined Stereocenters	9 / 9
E/Z Centers	0
Optical Activity	UNSPECIFIED

Approval Year

Targets

Primary Target	Pharmacology	Condition	Potency
Eukaryotic initiation factor 4A-I 1 Target ID: CHEMBL2052028 Sources: https://www.ncbi.nlm.nih.gov/pubmed/19401772 \| https://www.nature.com/articles/cdd2014210	Inhibitor 8297		60.0 nM [IC50]

Substance Class	Chemical Created by `admin` on `Sat Dec 16 15:38:35 UTC 2023` Edited by `admin` on `Sat Dec 16 15:38:35 UTC 2023`
Record UNII	KK3Y3KN5BV
Record Status	`Validated (UNII)`
Record Version

Download

Name

Type

Language

SILVESTROL

Common Name

English

Silvestrol [WHO-DD]

Common Name

English

1H-CYCLOPENTA(B)BENZOFURAN-2-CARBOXYLIC ACID, 6-(((2S,3R,6R)-6-((1R)-1,2-DIHYDROXYETHYL)-3-METHOXY-1,4-DIOXAN-2-YL)OXY)-2,3,3A,8B-TETRAHYDRO-1,8B-DIHYDROXY-8-METHOXY-3A-(4-METHOXYPHENYL)-3-PHENYL-, METHYL ESTER, (1R,2R,3S,3AR,8BS)-

Systematic Name

English

(-)-SILVESTROL

Common Name

English

Code System Code Type Description

EPA CompTox

DTXSID601028120