Roridin E

CAT: 0013-GTR19209710-01Size: 500 µgDry Ice: NoHazardous: No

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CAT#:0013-GTR19209710-01Size:500 µg

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Description

Roridin E is a potent inhibitor of multiple receptor tyrosine kinases (FGFR3, IGF-1R, PDGFRβ, TrkB) and demonstrates strong anti-proliferative and cytotoxic activity in various cancer cell lines, including breast cancer models. Its mechanism supports research in oncology, particularly for studying kinase signaling pathways in vitro.

CAS Number

16891-85-3

Field of Research

Infectious Disease & Virology

Smiles

CC (O) C1OCC\C (C) =C\C (=O) OCC23CCC (C) =CC2OC2CC (OC (=O) \C=C/C=C/1) C3 (C) C21CO1

Molecular Formula

C29H38O8

Molecular Weight

514.61

Storage Conditions

-20°C

Notes

For research use only.

Chemical Information

Roridin E

Roridin E is a trichothecene.

CAS Number	16891-85-3
PubChem CID	44593339
IUPAC Name	(1R,3R,8R,12E,17R,18E,20Z,24R,25S,26S)-17-[(1R)-1-hydroxyethyl]-5,13,25-trimethylspiro[2,10,16,23-tetraoxatetracyclo[22.2.1.03,8.08,25]heptacosa-4,12,18,20-tetraene-26,2'-oxirane]-11,22-dione
Molecular Formula	C29H38O8
Molecular Weight	514.6
XLogP	2.4
Topological Polar Surface Area	104
Hydrogen Bond Donor Count	1
Hydrogen Bond Acceptor Count	8
Rotatable Bond Count	1
Heavy Atom Count	37
Formal Charge	0
Complexity	1060

SMILES

CC1=C[C@@H]2[C@@]3(CC1)COC(=O)/C=C(/CCO[C@H](/C=C/C=C\C(=O)O[C@H]4[C@]3([C@]5(CO5)[C@@H](C4)O2)C)[C@@H](C)O)\C

InChI

InChI=1S/C29H38O8/c1-18-9-11-28-16-34-26(32)14-19(2)10-12-33-21(20(3)30)7-5-6-8-25(31)37-22-15-24(36-23(28)13-18)29(17-35-29)27(22,28)4/h5-8,13-14,20-24,30H,9-12,15-17H2,1-4H3/b7-5+,8-6-,19-14+/t20-,21-,22-,23-,24-,27-,28-,29+/m1/s1

InChIKey

KEEQQEKLEZRLDS-FLGSVKSYSA-N

Chemical Structure

2D Structure

CAS: 16891-85-3

CID: 44593339

Formula: C29H38O8

MW: 514.6

Interactive 3D Structure

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View on PubChem Raw 3D data

Computed Properties

Property	Value
Molecular Weight	514.6
XLogP3	2.4
Hydrogen Bond Donor Count	1
Hydrogen Bond Acceptor Count	8
Rotatable Bond Count	1
Exact Mass	514.25666817
Monoisotopic Mass	514.25666817
Topological Polar Surface Area	104 Å²
Heavy Atom Count	37
Formal Charge	0
Complexity	1060
Isotope Atom Count	0
Defined Atom Stereocenter Count	8
Undefined Atom Stereocenter Count	0
Defined Bond Stereocenter Count	3
Undefined Bond Stereocenter Count	0
Covalently-Bonded Unit Count	1
Compound Is Canonicalized	Yes

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Alternative Products

Catalog	Name
FR171536-01	Roridin A
HY-N14586	Roridin J
T41264-01	Roridin L2
T70276-01	Roridin E
HY-N14593	Roridin D
HY-N12908	Roridin H

Roridin E

Chemical Information

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