Tremerogen a-13
AlkaPlorer ID: AK467103
Synonym: None
IUPAC Name: (4S)-4-amino-5-[[2-[[2-[[2-[[(2S)-4-amino-1-[[(2S)-1-[[2-[[(2S)-3-carboxy-1-[(2S)-2-[[(2S)-1-[[2-[[(2S)-1-[[(1R)-1-carboxy-2-[(2E,6E)-3,7,11-trimethyldodeca-2,6,10-trienyl]sulfanylethyl]amino]-3-methyl-1-oxobutan-2-yl]amino]-2-oxoethyl]amino]-3-hydroxy-1-oxopropan-2-yl]carbamoyl]pyrrolidin-1-yl]-1-oxopropan-2-yl]amino]-2-oxoethyl]amino]-5-(diaminomethylideneamino)-1-oxopentan-2-yl]amino]-1,4-dioxobutan-2-yl]amino]-2-oxoethyl]amino]-2-oxoethyl]amino]-2-oxoethyl]amino]-5-oxopentanoic acid
Structure
SMILES: CC(C)=CCC/C(C)=C/CC/C(C)=C/CSC[C@H](N=C(O)[C@@H](N=C(O)CN=C(O)[C@H](CO)N=C(O)[C@@H]1CCCN1C(=O)[C@H](CC(=O)O)N=C(O)CN=C(O)[C@H](CCCNC(=N)N)N=C(O)[C@H](CC(=N)O)N=C(O)CN=C(O)CN=C(O)CN=C(O)[C@@H](N)CCC(=O)O)C(C)C)C(=O)O
InChI: InChI=1S/C60H97N17O20S/c1-32(2)11-7-12-34(5)13-8-14-35(6)19-22-98-31-41(59(96)97)75-57(94)51(33(3)4)76-48(84)29-70-54(91)40(30-78)74-56(93)42-16-10-21-77(42)58(95)39(24-50(87)88)72-47(83)28-69-53(90)37(15-9-20-65-60(63)64)73-55(92)38(23-43(62)79)71-46(82)27-67-44(80)25-66-45(81)26-68-52(89)36(61)17-18-49(85)86/h11,13,19,33,36-42,51,78H,7-10,12,14-18,20-31,61H2,1-6H3,(H2,62,79)(H,66,81)(H,67,80)(H,68,89)(H,69,90)(H,70,91)(H,71,82)(H,72,83)(H,73,92)(H,74,93)(H,75,94)(H,76,84)(H,85,86)(H,87,88)(H,96,97)(H4,63,64,65)/b34-13+,35-19+/t36-,37-,38-,39-,40-,41-,42-,51-/m0/s1
InChIKey: NJFDXFVHDXDFGP-JDYVOHCNSA-N
Source
| Species | Genus | Family | Order | Class | Phylum | Kingdom | Domain |
|---|---|---|---|---|---|---|---|
| Tremella mesenterica | Tremella | Tremellaceae | Tremellales | Tremellomycetes | Basidiomycota | Fungi | Eukaryota |
Properties Information
Molecule Weight: 1408.602
TPSA？: 642.9300000000003
MolLogP？: 4.45124
Number of H-Donors: 21
Number of H-Acceptors: 20
RingCount: 1
Activities Information
| Organism | Target Name | Standard Type | Standard Value | Standard Units | doi |
|---|