3,22,23-Trihydroxy-24-methyl-30-norlanost-8-en-29-oic acid; (3β,22R,23S,24R)-form, 3-O-(2-Acetamido-2-deoxy-β-D-glucopyranoside)
AlkaPlorer ID: AK316580
Synonym: Ulososide D
IUPAC Name: 3-[3-acetamido-4,5-dihydroxy-6-(hydroxymethyl)oxan-2-yl]oxy-17-(3,4-dihydroxy-5,6-dimethylheptan-2-yl)-4,10,13-trimethyl-1,2,3,5,6,7,11,12,14,15,16,17-dodecahydrocyclopenta[a]phenanthrene-4-carboxylic acid
Structure
SMILES: CC(=O)NC1C(OC2CCC3(C)C4=C(CCC3C2(C)C(=O)O)C2CCC(C(C)C(O)C(O)C(C)C(C)C)C2(C)CC4)OC(CO)C(O)C1O
InChI: InChI=1S/C38H63NO10/c1-18(2)19(3)30(42)31(43)20(4)23-10-11-24-22-9-12-27-37(7,25(22)13-15-36(23,24)6)16-14-28(38(27,8)35(46)47)49-34-29(39-21(5)41)33(45)32(44)26(17-40)48-34/h18-20,23-24,26-34,40,42-45H,9-17H2,1-8H3,(H,39,41)(H,46,47)
InChIKey: PXTVFQXMKYZJEC-UHFFFAOYSA-N
Source
| Species | Genus | Family | Order | Class | Phylum | Kingdom | Domain |
|---|---|---|---|---|---|---|---|
| None | Ulosa | Dictyonellidae | Bubarida | Demospongiae | Porifera | Metazoa | Eukaryota |
Properties Information
Molecule Weight: 693.9190000000001
TPSA？: 186.01
MolLogP？: 3.389200000000002
Number of H-Donors: 7
Number of H-Acceptors: 9
RingCount: 5
Activities Information
| Organism | Target Name | Standard Type | Standard Value | Standard Units | doi |
|---|