Azaspiracid 34

AlkaPlorer ID: AK289976

Synonym: None

IUPAC Name: None

Structure

SMILES: C=C(CC12CC(C)CC(O1)C1OC3(CC1O2)NCC(C)CC3C)C1OC(O)(C(O)C2CC3OC4(CCC5(CC=CC(CCC(=O)O)O5)O4)C(C)CC3O2)C(C)CC1C

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InChI: InChI=1S/C45H69NO12/c1-24-16-34-39-36(22-43(56-39)28(5)15-25(2)23-46-43)54-42(20-24,53-34)21-27(4)38-26(3)17-30(7)45(50,57-38)40(49)35-19-33-32(51-35)18-29(6)44(55-33)14-13-41(58-44)12-8-9-31(52-41)10-11-37(47)48/h8-9,24-26,28-36,38-40,46,49-50H,4,10-23H2,1-3,5-7H3,(H,47,48)

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InChIKey: ZACAZJIHLPHOFH-UHFFFAOYSA-N

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Reference

CAS: 1636140-24-3

Properties Information

Molecule Weight: 816.042

TPSA: 163.62999999999997

MolLogP: 5.6996000000000056

Number of H-Donors: 4

Number of H-Acceptors: 12

RingCount: 9

Activities Information

Organism Target Name Standard Type Standard Value Standard Units doi

Metabolism Information