Anacyclamide D10
AlkaPlorer ID: AK002842
Synonym: None
IUPAC Name: 3-[(3S,9S,12S,15S,18S,21S,24S,27S,30S)-12,27-bis(2-amino-2-oxoethyl)-9-benzyl-21-(1H-imidazol-5-ylmethyl)-18-(1H-indol-3-ylmethyl)-24-methyl-2,5,8,11,14,17,20,23,26,29-decaoxo-3-propan-2-yl-1,4,7,10,13,16,19,22,25,28-decazabicyclo[28.3.0]tritriacontan-15-yl]propanamide
Structure
SMILES: CC(C)[C@@H]1N=C(O)CN=C(O)[C@H](CC2=CC=CC=C2)N=C(O)[C@H](CC(=N)O)N=C(O)[C@H](CCC(=N)O)N=C(O)[C@H](CC2=CNC3=CC=CC=C23)N=C(O)[C@H](CC2=CN=CN2)N=C(O)[C@H](C)N=C(O)[C@H](CC(=N)O)N=C(O)[C@@H]2CCCN2C1=O
InChI: InChI=1S/C54H70N16O13/c1-27(2)45-54(83)70-17-9-14-40(70)53(82)68-38(21-42(56)72)49(78)62-28(3)46(75)64-37(20-31-24-58-26-61-31)51(80)66-36(19-30-23-59-33-13-8-7-12-32(30)33)50(79)63-34(15-16-41(55)71)48(77)67-39(22-43(57)73)52(81)65-35(18-29-10-5-4-6-11-29)47(76)60-25-44(74)69-45/h4-8,10-13,23-24,26-28,34-40,45,59H,9,14-22,25H2,1-3H3,(H2,55,71)(H2,56,72)(H2,57,73)(H,58,61)(H,60,76)(H,62,78)(H,63,79)(H,64,75)(H,65,81)(H,66,80)(H,67,77)(H,68,82)(H,69,74)/t28-,34-,35-,36-,37-,38-,39-,40-,45-/m0/s1
InChIKey: HNUXFUMWJWYVHO-BEFHOLDESA-N
Reference
Highly Diverse Cyanobactins in Strains of the Genus <i>Anabaena</i>
PubChem CID: 146684870
LOTUS: LTS0247791
{NPAtlas: NPA028853
Source
| Species | Genus | Family | Order | Class | Phylum | Kingdom | Domain |
|---|---|---|---|---|---|---|---|
| Anabaena sp. 90 | Anabaena | Nostocaceae | Nostocales | Cyanophyceae | Cyanobacteriota | None | Bacteria |
Properties Information
Molecule Weight: 1151.253
TPSA？: 490.3300000000001
MolLogP？: 6.322910000000012
Number of H-Donors: 17
Number of H-Acceptors: 14
RingCount: 6
Activities Information
| Organism | Target Name | Standard Type | Standard Value | Standard Units | doi |
|---|