(2S,3R,4S,5S,6R)-3,4,5-trihydroxy-6-(hydroxymethyl)oxan-2-yl (2Z)-2-[(3S,6'R,7'S,8'aS)-6'-ethenyl-2-oxo-3',5',6',7',8',8'a-hexahydro-1H,2'H-spiro[indole-3,1'-indolizine]-7'-yl]-3-methoxyprop-2-enoate

AlkaPlorer ID: AK340344

Synonym: None

IUPAC Name: [3,4,5-trihydroxy-6-(hydroxymethyl)oxan-2-yl] 2-(6'-ethenyl-2-oxospiro[1H-indole-3,1'-3,5,6,7,8,8a-hexahydro-2H-indolizine]-7'-yl)-3-methoxyprop-2-enoate

Structure

SMILES: C=CC1CN2CCC3(C(O)=NC4=CC=CC=C43)C2CC1C(=COC)C(=O)OC1OC(CO)C(O)C(O)C1O

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InChI: InChI=1S/C27H34N2O9/c1-3-14-11-29-9-8-27(17-6-4-5-7-18(17)28-26(27)35)20(29)10-15(14)16(13-36-2)24(34)38-25-23(33)22(32)21(31)19(12-30)37-25/h3-7,13-15,19-23,25,30-33H,1,8-12H2,2H3,(H,28,35)

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InChIKey: BBUOHZFHYRHXQC-UHFFFAOYSA-N

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Source

Species Genus Family Order Class Phylum Kingdom Domain
Uncaria rhynchophylla Uncaria Rubiaceae Gentianales Magnoliopsida Streptophyta Viridiplantae Eukaryota

Properties Information

Molecule Weight: 530.5740000000003

TPSA: 161.51

MolLogP: 0.2958000000000005

Number of H-Donors: 5

Number of H-Acceptors: 10

RingCount: 5

Activities Information

Organism Target Name Standard Type Standard Value Standard Units doi

Metabolism Information