2,4,6,9,11,14-hexahydroxy-3,7,10-trimethyl-11-(propan-2-yl)-15-oxapentacyclo[7.5.1.0¹,?.0?,¹³.0¹?,¹?]pentadecan-12-yl 1H-pyrrole-2-carboxylate
AlkaPlorer ID: AK269627
Synonym: None
IUPAC Name: (2,4,6,9,11,14-hexahydroxy-3,7,10-trimethyl-11-propan-2-yl-15-oxapentacyclo[7.5.1.01,6.07,13.010,14]pentadecan-12-yl) 1H-pyrrole-2-carboxylate
Structure
SMILES: CC1C(O)CC2(O)C3(C)CC4(O)OC2(C1O)C1(O)C3C(OC(=O)C2=CC=CN2)C(O)(C(C)C)C41C
InChI: InChI=1S/C25H35NO9/c1-11(2)23(32)17(34-18(29)13-7-6-8-26-13)15-19(4)10-22(31)20(23,5)24(15,33)25(35-22)16(28)12(3)14(27)9-21(19,25)30/h6-8,11-12,14-17,26-28,30-33H,9-10H2,1-5H3
InChIKey: ATCULRCRYDRGDU-UHFFFAOYSA-N
Source
| Species | Genus | Family | Order | Class | Phylum | Kingdom | Domain |
|---|---|---|---|---|---|---|---|
| Ryania speciosa | Ryania | Salicaceae | Malpighiales | Magnoliopsida | Streptophyta | Viridiplantae | Eukaryota |
Properties Information
Molecule Weight: 493.5530000000002
TPSA？: 172.7
MolLogP？: -0.3316999999999996
Number of H-Donors: 7
Number of H-Acceptors: 9
RingCount: 7
Activities Information
| Organism | Target Name | Standard Type | Standard Value | Standard Units | doi |
|---|