2-{14-[3-(acetyloxy)-5-hydroxy-6-methyloxan-2-yl]-4,10,14,19-tetramethyl-5,15-dioxo-21,22,23,24-tetraazapentacyclo[16.2.1.1³,?.1?,¹¹.1¹³,¹?]tetracosa-1(20),2,6(24),7,9,11,13(22),16,18-nonaen-4-yl}-5-hydroxy-6-methyloxan-3-yl acetate
AlkaPlorer ID: AK027992
Synonym: None
IUPAC Name: [(3R,5R,6R)-2-[(2R,12R)-12-[(3R,5R,6R)-3-acetyloxy-5-hydroxy-6-methyloxan-2-yl]-2,8,12,17-tetramethyl-3,13-dioxo-22,24-dihydroporphyrin-2-yl]-5-hydroxy-6-methyloxan-3-yl] acetate
Structure
SMILES: CC(=O)O[C@@H]1C[C@@H](O)[C@@H](C)OC1[C@]1(C)C(=O)C2=CC3=CC(C)=C(C=C4N=C(C=C5NC(=CC1=N2)C=C5C)C(=O)[C@@]4(C)C1O[C@H](C)[C@H](O)C[C@H]1OC(C)=O)N3
InChI: InChI=1S/C40H46N4O10/c1-17-10-24-12-33-39(7,37-31(53-21(5)45)15-29(47)19(3)51-37)35(49)27(43-33)11-23-9-18(2)26(41-23)14-34-40(8,36(50)28(44-34)13-25(17)42-24)38-32(54-22(6)46)16-30(48)20(4)52-38/h9-14,19-20,29-32,37-38,41-42,47-48H,15-16H2,1-8H3/t19-,20-,29-,30-,31-,32-,37?,38?,39+,40+/m1/s1
InChIKey: RQOFTLFCRJDAJR-OKVZEMHRSA-N
Reference
Further tolyporphins from the Blue-Green alga Tolypothrix nodosa.
PubChem CID: 21775645
LOTUS: LTS0155629
Source
| Species | Genus | Family | Order | Class | Phylum | Kingdom | Domain |
|---|---|---|---|---|---|---|---|
| Tolypothrix nodosa | Tolypothrix | Tolypothrichaceae | Nostocales | Cyanophyceae | Cyanobacteriota | None | Bacteria |
Properties Information
Molecule Weight: 742.8260000000001
TPSA？: 203.02
MolLogP？: 4.152840000000003
Number of H-Donors: 4
Number of H-Acceptors: 12
RingCount: 7
Activities Information
| Organism | Target Name | Standard Type | Standard Value | Standard Units | doi |
|---|