UNPD81890
AlkaPlorer ID: AK122946
Synonym: None
IUPAC Name: (9R,10E,12S,13S,16S)-9-ethyl-4,12-dihydroxy-3,16,23,25-tetramethyl-13-(2-methylprop-1-enyl)-14-oxa-20-azatetracyclo[19.3.1.05,24.016,22]pentacosa-1(25),2,4,10,17,21,23-heptaene-6,15,19-trione
Structure
SMILES: CC[C@H]1/C=C/[C@H](O)[C@H](C=C(C)C)OC(=O)[C@@]2(C)C=CC(O)=NC3=C(C)C4=CC(C)=C(O)C(=C4C(C)=C32)C(=O)CC1
InChI: InChI=1S/C33H39NO6/c1-8-21-9-11-23(35)25(15-17(2)3)40-32(39)33(7)14-13-26(37)34-30-19(5)22-16-18(4)31(38)28(24(36)12-10-21)27(22)20(6)29(30)33/h9,11,13-16,21,23,25,35,38H,8,10,12H2,1-7H3,(H,34,37)/b11-9+/t21-,23-,25-,33-/m0/s1
InChIKey: QBBWCNRGHXCLSU-FQQVEVELSA-N
Source
Properties Information
Molecule Weight: 545.6760000000002
TPSA？: 116.42000000000002
MolLogP？: 6.683960000000008
Number of H-Donors: 3
Number of H-Acceptors: 6
RingCount: 4
Activities Information
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