152340-46-0
AlkaPlorer ID: AK056270
Synonym: None
IUPAC Name: N-[(E,4S,5R,9R,10R,11R)-11-[(3R,5E,7E,11R,12S,13E,15R,17S,18S,19E,21R,23S,24R,25S,29S)-29-hydroxy-3,15,17,21,23-pentamethoxy-5,12,18,24-tetramethyl-9,27-dioxo-10,26-dioxabicyclo[23.3.1]nonacosa-1(28),5,7,13,19-pentaen-11-yl]-4,10-dimethoxy-5,9-dimethyl-6-oxododec-1-enyl]-N-methylformamide
Structure
SMILES: CO[C@H]1CC2=CC(=O)O[C@@H]([C@H](C)[C@@H](OC)C[C@@H](OC)/C=C/[C@H](C)[C@@H](OC)C[C@@H](OC)/C=C/[C@H](C)[C@H]([C@H](C)[C@H](OC)[C@H](C)CCC(=O)[C@H](C)[C@H](C/C=C/N(C)C=O)OC)OC(=O)/C=C/C=C(\C)C1)[C@H]2O
InChI: InChI=1S/C54H87NO14/c1-34-18-16-20-49(58)68-53(40(7)52(67-15)36(3)23-26-45(57)38(5)46(64-12)19-17-27-55(8)33-56)37(4)22-25-42(61-9)31-47(65-13)35(2)21-24-43(62-10)32-48(66-14)39(6)54-51(60)41(30-50(59)69-54)29-44(28-34)63-11/h16-18,20-22,24-25,27,30,33,35-40,42-44,46-48,51-54,60H,19,23,26,28-29,31-32H2,1-15H3/b20-16+,24-21+,25-22+,27-17+,34-18+/t35-,36+,37-,38-,39+,40+,42-,43-,44+,46-,47-,48-,51-,52+,53+,54-/m0/s1
InChIKey: LDRCIZMRSWUAMW-GTGWSDFISA-N
Source
| Species | Genus | Family | Order | Class | Phylum | Kingdom | Domain |
|---|---|---|---|---|---|---|---|
| Neosiphonia superstes | Neosiphonia | Rhodomelaceae | Ceramiales | Florideophyceae | Rhodophyta | None | Eukaryota |
Properties Information
Molecule Weight: 974.283
TPSA？: 174.82
MolLogP？: 7.562700000000012
Number of H-Donors: 1
Number of H-Acceptors: 14
RingCount: 2
Activities Information
| Organism | Target Name | Standard Type | Standard Value | Standard Units | doi |
|---|