Brassinolide

CAT: 0127-BUP10479-03Size: 25 mgDry Ice: NoHazardous: No

1 / 1

CAT#:0127-BUP10479-03Size:25 mg

Selected

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

Quick Request Actions

CAS Number

72962-43-7

Synonyms

Brassin lactone, 24-Epibrassinolide

MDL Number

MFCD00792745

Purity

=98%

Smiles

CC(C)C(C)C(O)C(O)C(C)C1CCC2C3COC(=O)C4CC(O)C(O)CC4(C)C3CCC12C

Chemical Information

Brassinolide

Brassinolide is a brassinosteroid, a 3alpha-hydroxy steroid, a 2alpha-hydroxy steroid, a 22-hydroxy steroid and a 23-hydroxy steroid. It has a role as a plant growth stimulator and a plant hormone.

CAS Number	72962-43-7
PubChem CID	115196
IUPAC Name	(1S,2R,4R,5S,7S,11S,12S,15R,16S)-15-[(2S,3R,4R,5S)-3,4-dihydroxy-5,6-dimethylheptan-2-yl]-4,5-dihydroxy-2,16-dimethyl-9-oxatetracyclo[9.7.0.02,7.012,16]octadecan-8-one
Molecular Formula	C28H48O6
Molecular Weight	480.7
XLogP	4.8
Topological Polar Surface Area	107
Hydrogen Bond Donor Count	4
Hydrogen Bond Acceptor Count	6
Rotatable Bond Count	5
Heavy Atom Count	34
Formal Charge	0
Complexity	755

SMILES

C[C@@H]([C@H]1CC[C@@H]2[C@@]1(CC[C@H]3[C@H]2COC(=O)[C@@H]4[C@@]3(C[C@H]([C@H](C4)O)O)C)C)[C@H]([C@@H]([C@@H](C)C(C)C)O)O

InChI

InChI=1S/C28H48O6/c1-14(2)15(3)24(31)25(32)16(4)18-7-8-19-17-13-34-26(33)21-11-22(29)23(30)12-28(21,6)20(17)9-10-27(18,19)5/h14-25,29-32H,7-13H2,1-6H3/t15-,16-,17-,18+,19-,20-,21+,22-,23+,24+,25+,27+,28+/m0/s1

InChIKey

IXVMHGVQKLDRKH-KNBKMWSGSA-N

Chemical Structure

2D Structure

CAS: 72962-43-7

CID: 115196

Formula: C28H48O6

MW: 480.7

Interactive 3D Structure

Loading 3D structure...

View on PubChem Raw 3D data

Computed Properties

Property	Value
Molecular Weight	480.7
XLogP3	4.8
Hydrogen Bond Donor Count	4
Hydrogen Bond Acceptor Count	6
Rotatable Bond Count	5
Exact Mass	480.34508925
Monoisotopic Mass	480.34508925
Topological Polar Surface Area	107 Å²
Heavy Atom Count	34
Formal Charge	0
Complexity	755
Isotope Atom Count	0
Defined Atom Stereocenter Count	13
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
A3265-5	Brassinolide

Brassinolide

Chemical Information

Alternative Products

Popular Products