(1R,5R,6R,7S,8S,9S,12S,13S)-5,7,8,12,13-pentahydroxy-3-imino-8-methyl-10-oxa-2,4-diazatricyclo[7.3.1.0¹,⁶]tridecan-11-one
AlkaPlorer ID: AK209636
Synonym: None
IUPAC Name: (1R,5R,6R,7S,8S,9S,12S,13S)-3-amino-5,7,8,12,13-pentahydroxy-8-methyl-10-oxa-2,4-diazatricyclo[7.3.1.01,6]tridec-3-en-11-one
Structure
SMILES: C[C@]1(O)[C@@H](O)[C@@H]2[C@@H](O)NC(=N)N[C@]23[C@H](O)C(=O)O[C@H]1[C@H]3O
InChI: InChI=1S/C11H17N3O7/c1-10(20)3(15)2-7(18)13-9(12)14-11(2)4(16)6(10)21-8(19)5(11)17/h2-7,15-18,20H,1H3,(H3,12,13,14)/t2-,3+,4-,5-,6+,7-,10+,11-/m1/s1
InChIKey: PJSIAXHRXKZYIN-NLMYMXDXSA-N
Source
| Species | Genus | Family | Order | Class | Phylum | Kingdom | Domain |
|---|---|---|---|---|---|---|---|
| Taricha granulosa | Taricha | Salamandridae | Caudata | Amphibia | Chordata | Metazoa | Eukaryota |
Properties Information
Molecule Weight: 303.271
TPSA？: 175.35999999999996
MolLogP？: -4.439929999999994
Number of H-Donors: 8
Number of H-Acceptors: 8
RingCount: 3
Activities Information
| Organism | Target Name | Standard Type | Standard Value | Standard Units | doi |
|---|