Bis(gorgiacerol)amine
AlkaPlorer ID: AK290727
Synonym: None
IUPAC Name: methyl 8-hydroxy-7-[[8-hydroxy-12-methoxycarbonyl-5-oxo-2,9-bis(prop-1-en-2-yl)-4,14-dioxatricyclo[9.2.1.13,6]pentadeca-1(13),6(15),11-trien-7-yl]amino]-5-oxo-2,9-bis(prop-1-en-2-yl)-4,14-dioxatricyclo[9.2.1.13,6]pentadeca-1(13),6(15),11-triene-12-carboxylate
Structure
SMILES: C=C(C)C1CC2=C(C(=O)OC)C=C(O2)C(C(=C)C)C2C=C(C(=O)O2)C(NC2C3=CC(OC3=O)C(C(=C)C)C3=CC(C(=O)OC)=C(CC(C(=C)C)C2O)O3)C1O
InChI: InChI=1S/C42H47NO12/c1-17(2)21-11-27-23(39(46)50-9)13-29(52-27)33(19(5)6)31-15-25(41(48)54-31)35(37(21)44)43-36-26-16-32(55-42(26)49)34(20(7)8)30-14-24(40(47)51-10)28(53-30)12-22(18(3)4)38(36)45/h13-16,21-22,31-38,43-45H,1,3,5,7,11-12H2,2,4,6,8-10H3
InChIKey: JNHYDXTWWOIVKJ-UHFFFAOYSA-N
Source
| Species | Genus | Family | Order | Class | Phylum | Kingdom | Domain |
|---|---|---|---|---|---|---|---|
| None | Pseudopterogorgia | Gorgoniidae | Malacalcyonacea | Anthozoa | Cnidaria | Metazoa | Eukaryota |
Properties Information
Molecule Weight: 757.8330000000001
TPSA？: 183.97
MolLogP？: 4.714400000000006
Number of H-Donors: 3
Number of H-Acceptors: 13
RingCount: 6
Activities Information
| Organism | Target Name | Standard Type | Standard Value | Standard Units | doi |
|---|