Delelatine

AlkaPlorer ID: AK018157

Synonym: ''

IUPAC Name: (1R,2S,3S,4S,5R,6R,8S,12R,13R,16S,19R,20S,21S)-14-ethyl-6,19-dimethoxy-16-methyl-9,11-dioxa-14-azaheptacyclo[10.7.2.12,5.01,13.03,8.08,12.016,20]docosane-4,21-diol

Structure

SMILES: CCN1C[C@@]2(C)CC[C@@H](OC)[C@]34[C@@H]1[C@@]1(OCO[C@]15C[C@@H](OC)[C@@H]1C[C@H]3[C@H]5[C@H]1O)[C@@H](O)[C@@H]24

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InChI: InChI=1S/C24H37NO6/c1-5-25-10-21(2)7-6-15(29-4)23-13-8-12-14(28-3)9-22(16(13)17(12)26)24(20(23)25,31-11-30-22)19(27)18(21)23/h12-20,26-27H,5-11H2,1-4H3/t12-,13-,14+,15+,16-,17-,18-,19-,20+,21+,22-,23+,24-/m0/s1

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InChIKey: RLBOHEVJVBXZQZ-UBDCJZAMSA-N

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Source

Properties Information

Molecule Weight: 435.56100000000015

TPSA: 80.62

MolLogP: 1.010100000000001

Number of H-Donors: 2

Number of H-Acceptors: 7

RingCount: 7

Activities Information

Organism Target Name Standard Type Standard Value Standard Units doi

Metabolism Information