Azadirachtin

CAT: 0572-TRC-A797300-10MGSize: 10 mgDry Ice: NoHazardous: No

1 / 1

CAT#:0572-TRC-A797300-10MGSize:10 mg

Selected

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

Quick Request Actions

CAS Number

11141-17-6

Synonyms

2,7-Methanofuro[2,3-b]oxireno[e]oxepin, 1H,7H-naphtho[1,8-bc:4,4a-c']difuran-5,10a(8H)-dicarboxylic acid deriv.; Align; AzaMax; Azadirachtin; Azadirachtin A; Azatin; Azatin EC; Azatin Magnum; Azatin XL; BioNEEM; Biosal; Ecozin; Gronim; NeemAzal; NeemAzal F; NeemAzal T; NeemAzal T/S; NeemAzal W; Neemazol; Neemgold; Nimbicidine; Nimurin; Oikos; Oikos 25 plus; Oikos 323 Bio; Ornazin; Safer BioNEEM; Suneem; Superneem

Hazard Statement

Toxic if inhaled; UN number: UN2588; Packing Group: III

Purity

>95% (HPLC)

Smiles

COC(=O)[C@@]1(O)OC[C@@]23[C@H](C[C@@H](OC(=O)C)[C@]4(CO[C@@H]([C@@H](O)[C@](C)([C@H]12)[C@]56O[C@@]5(C)[C@H]7C[C@@H]6O[C@@H]8OC=C[C@]78O)[C@H]34)C(=O)OC)OC(=O)\C(=C\C)\C

Molecular Formula

C35 H44 O16

Molecular Weight

720.72

InChI

InChI=1S/C35H44O16/c1-8-15(2)24(38)49-18-12-19(48-16(3)36)32(26(39)43-6)13-46-21-22(32)31(18)14-47-34(42,27(40)44-7)25(31)29(4,23(21)37)35-20-11-17(30(35,5)51-35)33(41)9-10-45-28(33)50-20/h8-10,17-23,25,28,37,41-42H,11-14H2,1-7H3/b15-8+/t17-,18+,19-,20+,21-,22-,23-,25+,28+,29-,30+,31+,32+,33+,34+,35+/m1/s1

Additionnal Information

IUPAC name: dimethyl (1S,4S,5R,6S,7S,8R,11S,12R,14S,15R)-12-acetoxy-4,7-dihydroxy-6-[(2S,6S,9R,11S)-2-hydroxy-11-methyl-5,7,10-trioxatetracyclo[6.3.1.0^{2,6}.0^{9,11}]dodec-3-en-9-yl]-6-methyl-14-[(E)-2-methylbut-2-enoyl]oxy-3,9-dioxatetracyclo[6.6.1.0^{1,5}.0^{11,15}]pentadecane-4,11-dicarboxylate

Shipping Conditions

Room Temperature

Storage Conditions

-20°C

Chemical Information

Azadirachtin

Azadirachtin A is a member of the family of azadirachtins that is isolated from the neem tree (Azadirachta indica). It has a role as a hepatoprotective agent. It is a methyl ester, a tertiary alcohol, an epoxide, a secondary alcohol, an organic heterotetracyclic compound, an azadirachtin, an acetate ester, an enoate ester and a cyclic hemiketal.

CAS Number	11141-17-6
PubChem CID	5281303
IUPAC Name	dimethyl (1S,4S,5R,6S,7S,8R,11S,12R,14S,15R)-12-acetyloxy-4,7-dihydroxy-6-[(1S,2S,6S,8S,9R,11S)-2-hydroxy-11-methyl-5,7,10-trioxatetracyclo[6.3.1.02,6.09,11]dodec-3-en-9-yl]-6-methyl-14-[(E)-2-methylbut-2-enoyl]oxy-3,9-dioxatetracyclo[6.6.1.01,5.011,15]pentadecane-4,11-dicarboxylate
Molecular Formula	C35H44O16
Molecular Weight	720.7
XLogP	-0.6
Topological Polar Surface Area	215
Hydrogen Bond Donor Count	3
Hydrogen Bond Acceptor Count	16
Rotatable Bond Count	10
Heavy Atom Count	51
Formal Charge	0
Complexity	1660

SMILES

C/C=C(\C)/C(=O)O[C@H]1C[C@H]([C@]2(CO[C@@H]3[C@@H]2[C@]14CO[C@@]([C@H]4[C@]([C@@H]3O)(C)[C@@]56[C@@H]7C[C@H]([C@@]5(O6)C)[C@]8(C=CO[C@H]8O7)O)(C(=O)OC)O)C(=O)OC)OC(=O)C

InChI

InChIKey

FTNJWQUOZFUQQJ-NDAWSKJSSA-N

Chemical Structure

2D Structure

CAS: 11141-17-6

CID: 5281303

Formula: C35H44O16

MW: 720.7

Interactive 3D Structure

Loading 3D structure...

View on PubChem Raw 3D data

Computed Properties

Property	Value
Molecular Weight	720.7
XLogP3	-0.6
Hydrogen Bond Donor Count	3
Hydrogen Bond Acceptor Count	16
Rotatable Bond Count	10
Exact Mass	720.26293531
Monoisotopic Mass	720.26293531
Topological Polar Surface Area	215 Å²
Heavy Atom Count	51
Formal Charge	0
Complexity	1660
Isotope Atom Count	0
Defined Atom Stereocenter Count	16
Undefined Atom Stereocenter Count	0
Defined Bond Stereocenter Count	1
Undefined Bond Stereocenter Count	0
Covalently-Bonded Unit Count	1
Compound Is Canonicalized	Yes

Alternative Products

Catalog	Name
TBW00094	Azadirachtin
FA18055-01	Azadirachtin A
TBZ0072	Azadirachtin I
HY-133108-01	Azadirachtin B
GTR19279240-01	Azadirachtin H
GTR19279274-01	Azadirachtin D

Azadirachtin

Chemical Information

Alternative Products

Popular Products