11-ethyl-4,6,16,18-tetramethoxy-13-(methoxymethyl)-11-azahexacyclo[7.7.2.1²,?.0¹,¹?.0³,?.0¹³,¹?]nonadecan-8-ol

AlkaPlorer ID: AK044577

Synonym: None

IUPAC Name: (4R,6S,8R,9S,13S,18R)-11-ethyl-4,6,16,18-tetramethoxy-13-(methoxymethyl)-11-azahexacyclo[7.7.2.12,5.01,10.03,8.013,17]nonadecan-8-ol

Structure

SMILES: CCN1C[C@]2(COC)CCC(OC)C34C5CC6[C@@H](OC)C5[C@](O)(C[C@@H]6OC)[C@@H](C13)[C@H](OC)C42

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InChI: InChI=1S/C26H43NO6/c1-7-27-12-24(13-29-2)9-8-17(31-4)26-15-10-14-16(30-3)11-25(28,18(15)20(14)32-5)19(23(26)27)21(33-6)22(24)26/h14-23,28H,7-13H2,1-6H3/t14?,15?,16-,17?,18?,19+,20+,21-,22?,23?,24-,25+,26?/m0/s1

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InChIKey: VWYQWWYODNKZAS-ZAUDRUAFSA-N

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Reference

PubChem CID: 5316859

NPASS: NPC101352

Properties Information

Molecule Weight: 465.6310000000002

TPSA: 69.62

MolLogP: 1.8102000000000016

Number of H-Donors: 1

Number of H-Acceptors: 7

RingCount: 6

Activities Information

Organism Target Name Standard Type Standard Value Standard Units doi

Metabolism Information