Isoviolanthin

CAT: 0931-T13741-01Size: 50 mgDry Ice: NoHazardous: No

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CAT#:0931-T13741-01Size:50 mg

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24/48H Stock Items & 2 to 6 Weeks non Stock Items.

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CAS Number

40788-84-9

Target

TGF-beta/Smad, Akt, MMP, Histone Demethylase, mTOR, Others, PI3K

Related Pathways

Chromatin/Epigenetic, PI3K/Akt/mTOR signaling, Cytoskeletal Signaling, Stem Cells, Others, Proteases/Proteasome

Purity

0.9966

Bioactivity

Isoviolanthin reduces the migratory and invasive capacities of TGF-β1-treated HCC cells without cytotoxic effects on normal live cells and has potential as a therapeutic agent for the treatment of advanced-stage metastatic HCC. Isoviolanthin is a flavonoid glycoside extracted from the leaves of Dendrobium Officinale.

Smiles

C[C@@H]1O[C@H]([C@H](O)[C@H](O)[C@H]1O)c1c(O)c([C@@H]2O[C@H](CO)[C@@H](O)[C@H](O)[C@H]2O)c2oc(cc(=O)c2c1O)-c1ccc(O)cc1

Molecular Formula

C27H30O14

Molecular Weight

578.52

Shipping Conditions

Ice Packs

Storage Temperature

-20°C

Chemical Information

Isoviolanthin

Isoviolanthin has been reported in Passiflora sexflora, Dendrobium crystallinum, and Angiopteris evecta with data available.

CAS Number	40788-84-9
PubChem CID	101422758
IUPAC Name	5,7-dihydroxy-2-(4-hydroxyphenyl)-8-[(2S,3R,4R,5S,6R)-3,4,5-trihydroxy-6-(hydroxymethyl)oxan-2-yl]-6-[(2S,3R,4R,5R,6S)-3,4,5-trihydroxy-6-methyloxan-2-yl]chromen-4-one
Molecular Formula	C27H30O14
Molecular Weight	578.5
XLogP	-1.8
Topological Polar Surface Area	247
Hydrogen Bond Donor Count	10
Hydrogen Bond Acceptor Count	14
Rotatable Bond Count	4
Heavy Atom Count	41
Formal Charge	0
Complexity	970

SMILES

C[C@H]1[C@@H]([C@H]([C@H]([C@@H](O1)C2=C(C(=C3C(=C2O)C(=O)C=C(O3)C4=CC=C(C=C4)O)[C@H]5[C@@H]([C@H]([C@@H]([C@H](O5)CO)O)O)O)O)O)O)O

InChI

InChI=1S/C27H30O14/c1-8-17(31)21(35)23(37)26(39-8)15-19(33)14-11(30)6-12(9-2-4-10(29)5-3-9)40-25(14)16(20(15)34)27-24(38)22(36)18(32)13(7-28)41-27/h2-6,8,13,17-18,21-24,26-29,31-38H,7H2,1H3/t8-,13+,17-,18+,21+,22-,23+,24+,26-,27-/m0/s1

InChIKey

TWBWSPDILHVKEV-RSPRXDBDSA-N

Chemical Structure

2D Structure

CAS: 40788-84-9

CID: 101422758

Formula: C27H30O14

MW: 578.5

Interactive 3D Structure

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View on PubChem Raw 3D data

Computed Properties

Property	Value
Molecular Weight	578.5
XLogP3	-1.8
Hydrogen Bond Donor Count	10
Hydrogen Bond Acceptor Count	14
Rotatable Bond Count	4
Exact Mass	578.16355563
Monoisotopic Mass	578.16355563
Topological Polar Surface Area	247 Å²
Heavy Atom Count	41
Formal Charge	0
Complexity	970
Isotope Atom Count	0
Defined Atom Stereocenter Count	10
Undefined Atom Stereocenter Count	0
Defined Bond Stereocenter Count	0
Undefined Bond Stereocenter Count	0
Covalently-Bonded Unit Count	1
Compound Is Canonicalized	Yes

Alternative Products

Catalog	Name
MBS5754329	Isoviolanthin
HY-N6896R	Isoviolanthin (Standard)

Isoviolanthin

Chemical Information

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