(2R,3R,4S,5S,6R)-2-{[(1S,17S,18S,19S)-17-hydroxy-5,7-dioxa-12-azapentacyclo[10.6.1.0²,¹⁰.0⁴,⁸.0¹⁵,¹⁹]nonadeca-2(10),3,8,15-tetraen-18-yl]oxy}-6-(hydroxymethyl)oxane-3,4,5-triol

AlkaPlorer ID: AK318975

Synonym: None

IUPAC Name: None

Structure

SMILES: OC[C@H]1O[C@@H](O[C@H]2[C@H]3C4=CC5=C(C=C4CN4CCC(=C[C@@H]2O)[C@H]34)OCO5)[C@H](O)[C@@H](O)[C@@H]1O

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InChI: InChI=1S/C22H27NO9/c24-7-15-18(26)19(27)20(28)22(31-15)32-21-12(25)3-9-1-2-23-6-10-4-13-14(30-8-29-13)5-11(10)16(21)17(9)23/h3-5,12,15-22,24-28H,1-2,6-8H2/t12-,15+,16-,17+,18+,19-,20+,21+,22-/m0/s1

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InChIKey: NVHVNOCMXAHWMA-JXXVXVCISA-N

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Reference

SuperNatural Ⅲ: SN0256238-04

NPASS: NPC195181

Properties Information

Molecule Weight: 449.4560000000001

TPSA: 141.31

MolLogP: -1.4271999999999987

Number of H-Donors: 5

Number of H-Acceptors: 10

RingCount: 6

Activities Information

Organism Target Name Standard Type Standard Value Standard Units doi

Metabolism Information