5-Carboxystrictosidine

AlkaPlorer ID: AK291709

Synonym: Tetrahydrodeoxycordifoline

IUPAC Name: 1-[[3-ethenyl-5-methoxycarbonyl-2-[3,4,5-trihydroxy-6-(hydroxymethyl)oxan-2-yl]oxy-3,4-dihydro-2H-pyran-4-yl]methyl]-2,3,4,9-tetrahydro-1H-pyrido[3,4-b]indole-3-carboxylic acid

Structure

SMILES: C=CC1C(OC2OC(CO)C(O)C(O)C2O)OC=C(C(=O)OC)C1CC1NC(C(=O)O)CC2=C1NC1=CC=CC=C21

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InChI: InChI=1S/C28H34N2O11/c1-3-12-14(8-18-21-15(9-19(29-18)25(35)36)13-6-4-5-7-17(13)30-21)16(26(37)38-2)11-39-27(12)41-28-24(34)23(33)22(32)20(10-31)40-28/h3-7,11-12,14,18-20,22-24,27-34H,1,8-10H2,2H3,(H,35,36)

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InChIKey: LHKZIVMTXZLOTP-UHFFFAOYSA-N

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Properties Information

Molecule Weight: 574.5830000000003

TPSA: 200.03

MolLogP: -0.1538999999999979

Number of H-Donors: 7

Number of H-Acceptors: 11

RingCount: 5

Activities Information

Organism Target Name Standard Type Standard Value Standard Units doi

Metabolism Information