Notoamide O

Formula: C26H29N3O6
Molecular weight: 479.50
Smiles: CC1(C=CC2=C(O1)C=CC3=C2NC4(C3=O)C(C5CC67CCCN6C(=O)C5(C(O4)O)NC7=O)(C)C)C

Download

Notoamide O

Names

Structural Information

Physico-chemical Properties

ADME

Toxicity

Medical Chemistry

Fungi

Mycotoxin name: Notoamide O
First synonym: None
Synonyms: Notoamide O,(1'S,2S,3'S,7'R,8'R)-7'-hydroxy-4',4',7,7-tetramethylspiro[1H-pyrano[2,3-g]indole-2,5'-6-oxa-10,15-diazatetracyclo[6.5.2.01,10.03,8]pentadecane]-3,9',14'-trione,(1'S,2S,3'S,7'R,8'R)-7'-hydroxy-4',4',7,7-tetramethylspiro(1H-pyrano(2,3-g)indole-2,5'-6-oxa-10,15-diazatetracyclo(6.5.2.01,10.03,8)pentadecane)-3,9',14'-trione,(1'S,2S,3'S,7'S,8'R)-7'-hydroxy-4',4',7,7-tetramethylspiro(1H-pyrano(2,3-g)indole-2,5'-6-oxa-10,15-diazatetracyclo(6.5.2.01,10.03,8)pentadecane)-3,9',14'-trione,(1'S,2S,3'S,7'S,8'R)-7'-hydroxy-4',4',7,7-tetramethylspiro[1H-pyrano[2,3-g]indole-2,5'-6-oxa-10,15-diazatetracyclo[6.5.2.01,10.03,8]pentadecane]-3,9',14'-trione,CHEBI:198311

Smiles: CC1(C=CC2=C(O1)C=CC3=C2NC4(C3=O)C(C5CC67CCCN6C(=O)C5(C(O4)O)NC7=O)(C)C)C
Isomeric smiles: CC1(C=CC2=C(O1)C=CC3=C2N[C@@]4(C3=O)C([C@@H]5C[C@]67CCCN6C(=O)[C@@]5([C@@H](O4)O)NC7=O)(C)C)C
Inchi: InChI=1S/C26H29N3O6/c1-22(2)10-8-13-15(34-22)7-6-14-17(13)27-26(18(14)30)23(3,4)16-12-24-9-5-11-29(24)20(32)25(16,21(33)35-26)28-19(24)31/h6-8,10,16,21,27,33H,5,9,11-12H2,1-4H3,(H,28,31)/t16-,21+,24-,25-,26+/m0/s1
Inchikey: ZPXKISNDQRGXBE-OJUKFVNASA-N

Select an endpoint:

Endpoint	Tool	QSAR ID	Value	Unit	Comments	Reference

Select an endpoint:

Category	Endpoint	Tool	QSAR ID	Value	Unit	Comments	Reference

Select an endpoint:

Category	Sub category	Endpoint	Tool	QSAR ID	Value	Unit	Comments	Reference

Select an endpoint:

Endpoint	Tool	Value	Unit	Comments	Reference