AG00FEDE

Name: Destruxin A
Brand: Angene Chemical
SKU: AG00FEDE

6686-70-0 | Destruxin A

AG00FEDE

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CAS Number	6686-70-0
Catalog Number	AG00FEDE(AGN-PC-0TMFGI)
Chemical Name	Destruxin A
IUPAC Name	(3R,10S,13S,16S,19S)-16-[(2S)-butan-2-yl]-10,11,14-trimethyl-13-propan-2-yl-3-prop-2-enyl-4-oxa-1,8,11,14,17-pentazabicyclo[17.3.0]docosane-2,5,9,12,15,18-hexone
InChI	InChI=1S/C29H47N5O7/c1-9-12-21-27(38)34-16-11-13-20(34)26(37)31-23(18(5)10-2)28(39)33(8)24(17(3)4)29(40)32(7)19(6)25(36)30-15-14-22(35)41-21/h9,17-21,23-24H,1,10-16H2,2-8H3,(H,30,36)(H,31,37)/t18-,19-,20-,21+,23-,24-/m0/s1
InChI Key	XIYSEKITPHTMJT-OCCJOITDSA-N
MDL Number	MFCD01736100
Molecular Formula	C29H47N5O7
Molecular Weight	577.7128
SMILES	O=C1[C@]2(N(C(=O)[C@@H](CC=C)OC(=O)CCNC(=O)[C@H](C)N(C)C(=O)[C@H]([C@H](C)C)N(C)C(=O)[C@]([C@H](CC)C)(N1)[H])CCC2)[H]
UNII	255H1K2LFG
Synonyms	destruxin A, destruxin DA, Destruxin A, UNII-255H1K2LFG, 255H1K2LFG, NSC 361126, 6686-70-0, BRN 0601694, ZINC49889039, C29H47N5O7, C29-H47-N5-O7, CID11421831,

Complexity	1020
Compound Is Canonicalized	Yes
Covalently-Bonded Unit Count	1
Defined Atom Stereocenter Count	6
Defined Bond Stereocenter Count	0
Exact Mass	577.348g/mol
Formal Charge	0
Heavy Atom Count	41
Hydrogen Bond Acceptor Count	7
Hydrogen Bond Donor Count	2
Isotope Atom Count	0
Molecular Weight	577.723g/mol
Monoisotopic Mass	577.348g/mol
Rotatable Bond Count	5
Topological Polar Surface Area	145A^2
Undefined Atom Stereocenter Count	0
Undefined Bond Stereocenter Count	0
XLogP3	2.3

CERTIFICATE OF ANALYSIS

Analysis Data:

Test:

Result:

Conclusion: The above product meets the specifications of Angene.

Analyst:Chase

Date:

Reviewed by:Jessie

Date:

Angene International Limited