Actinomycin D2

CAT: 0931-T68797-01Size: 25 mgDry Ice: NoHazardous: No

1 / 1

CAT#:0931-T68797-01Size:25 mg

Selected

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

Quick Request Actions

CAS Number

72751-56-5

Target

Others

Related Pathways

Others

Bioactivity

Actinomycin D2 is a DNA inhibitor.

Smiles

C(NC1C(=O)NC(C(C)C)C(=O)N2C(CCC2)C(=O)N(C)CC(=O)N(C)C(C(C)C)C(=O)OC1C)(=O)C3=C4C(OC=5C(=N4)C(C(NC6C(=O)NC(C(C)C)C(=O)N7C(CCC7)C(=O)N(C)CC(=O)N(C)C(C(C)C)C(=O)OC6C)=O)=C(N)C(=O)C5C)=C(C)C(NC(COC(C(NC(COC(C(C(C)C)N)=O)=O)C(C)C)=O)=O)=C3

Molecular Formula

C76H109N15O22

Molecular Weight

1584.77

Shipping Conditions

Ice Packs

Storage Temperature

-20°C

Chemical Information

Actinomycin D2

Actinomycin D2 is a cyclodepsipeptide.

CAS Number	72751-56-5
PubChem CID	139590299
IUPAC Name	2-butyl-9,11-dimethyl-4-N,6-N-bis[(3R,6S,7R,10S,16S)-7,11,14-trimethyl-2,5,9,12,15-pentaoxo-3,10-di(propan-2-yl)-8-oxa-1,4,11,14-tetrazabicyclo[14.3.0]nonadecan-6-yl]-5H-[1,3]oxazolo[4,5-b]phenoxazine-4,6-dicarboxamide
Molecular Formula	C67H94N12O16
Molecular Weight	1323.5
XLogP	6.6
Topological Polar Surface Area	338
Hydrogen Bond Donor Count	5
Hydrogen Bond Acceptor Count	18
Rotatable Bond Count	11
Heavy Atom Count	95
Formal Charge	0
Complexity	2900

SMILES

CCCCC1=NC2=C(C3=C(C(=C2O1)C)OC4=C(C=CC(=C4N3)C(=O)N[C@H]5[C@H](OC(=O)[C@@H](N(C(=O)CN(C(=O)[C@@H]6CCCN6C(=O)[C@H](NC5=O)C(C)C)C)C)C(C)C)C)C)C(=O)N[C@H]7[C@H](OC(=O)[C@@H](N(C(=O)CN(C(=O)[C@@H]8CCCN8C(=O)[C@H](NC7=O)C(C)C)C)C)C(C)C)C

InChI

InChI=1S/C67H94N12O16/c1-18-19-24-42-68-51-45(59(83)73-49-38(13)93-67(91)54(34(8)9)77(17)44(81)30-75(15)63(87)41-23-21-28-79(41)65(89)47(32(4)5)71-61(49)85)52-57(36(11)56(51)94-42)95-55-35(10)25-26-39(50(55)69-52)58(82)72-48-37(12)92-66(90)53(33(6)7)76(16)43(80)29-74(14)62(86)40-22-20-27-78(40)64(88)46(31(2)3)70-60(48)84/h25-26,31-34,37-38,40-41,46-49,53-54,69H,18-24,27-30H2,1-17H3,(H,70,84)(H,71,85)(H,72,82)(H,73,83)/t37-,38-,40+,41+,46-,47-,48+,49+,53+,54+/m1/s1

InChIKey

LVUIWVVYJPULHQ-ZXCQBMGPSA-N

Chemical Structure

2D Structure

CAS: 72751-56-5

CID: 139590299

Formula: C67H94N12O16

MW: 1323.5

Interactive 3D Structure

Loading 3D structure...

View on PubChem Raw 3D data

Computed Properties

Property	Value
Molecular Weight	1323.5
XLogP3	6.6
Hydrogen Bond Donor Count	5
Hydrogen Bond Acceptor Count	18
Rotatable Bond Count	11
Exact Mass	1322.69107496
Monoisotopic Mass	1322.69107496
Topological Polar Surface Area	338 Å²
Heavy Atom Count	95
Formal Charge	0
Complexity	2900
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

Related Products

Catalog	Name
T68795-01	Actinomycin D1
T39319	Actinomycin X2
TMID-0145-01	Methylprednisolone-d2
T126336-01	Ciwujianoside D2
T13831	Prostaglandin D2
T12707-01	Resolvin D2
TMIH-0530	Sulbactam-d2
T1086	Vitamin D2
TMIR-0010-01	Ibuprofen-d2
TMIJ-0078-01	Glycine-d2

Actinomycin D2

Chemical Information

Related Products

Popular Products