6,9,11,13,14-pentahydroxy-3,7,10-trimethyl-11-(propan-2-yl)-12-(1H-pyrrole-2-carbonyloxy)-15-oxapentacyclo[7.5.1.0¹,?.0?,¹³.0¹?,¹?]pentadecan-2-yl 1H-pyrrole-2-carboxylate
AlkaPlorer ID: AK252118
Synonym: None
IUPAC Name: [6,9,11,13,14-pentahydroxy-3,7,10-trimethyl-11-propan-2-yl-12-(1H-pyrrole-2-carbonyloxy)-15-oxapentacyclo[7.5.1.01,6.07,13.010,14]pentadecan-2-yl] 1H-pyrrole-2-carboxylate
Structure
SMILES: CC1CCC2(O)C3(C)CC4(O)OC2(C1OC(=O)C1=CC=CN1)C1(O)C3(O)C(OC(=O)C2=CC=CN2)C(O)(C(C)C)C41C
InChI: InChI=1S/C30H38N2O10/c1-15(2)27(37)22(41-21(34)18-9-7-13-32-18)28(38)23(4)14-26(36)24(27,5)30(28,39)29(42-26)19(16(3)10-11-25(23,29)35)40-20(33)17-8-6-12-31-17/h6-9,12-13,15-16,19,22,31-32,35-39H,10-11,14H2,1-5H3
InChIKey: NQSPKGSAHXUJAL-UHFFFAOYSA-N
Source
| Species | Genus | Family | Order | Class | Phylum | Kingdom | Domain |
|---|---|---|---|---|---|---|---|
| Ryania speciosa | Ryania | Salicaceae | Malpighiales | Magnoliopsida | Streptophyta | Viridiplantae | Eukaryota |
Properties Information
Molecule Weight: 586.638
TPSA？: 194.56
MolLogP？: 1.0051999999999983
Number of H-Donors: 7
Number of H-Acceptors: 10
RingCount: 8
Activities Information
| Organism | Target Name | Standard Type | Standard Value | Standard Units | doi |
|---|