Majusimine C
AlkaPlorer ID: AK133762
Synonym: 'majusimine C', '(-)-Majusimine C'
IUPAC Name: [(1R,2S,3R,4S,5R,6R,7S,8S,9R,11R,12S,13S,14R,16S,17S,18S)-4,6,18-triacetyloxy-5-benzoyloxy-7-formyl-16,17-dihydroxy-7,10-dimethyl-15-methylidene-10-azahexacyclo[7.7.1.12,14.01,12.03,8.03,11]octadecan-13-yl] benzoate
Structure
SMILES: C=C1[C@H]2[C@@H](OC(=O)C3=CC=CC=C3)[C@@H]3[C@H]4N(C)[C@H]5[C@@H](O)[C@@]3([C@@H]([C@@H]2OC(C)=O)[C@@]42[C@H](OC(C)=O)[C@@H](OC(=O)C3=CC=CC=C3)[C@H](OC(C)=O)[C@@](C)(C=O)[C@@H]52)[C@H]1O
InChI: InChI=1S/C41H43NO13/c1-18-24-27(54-37(49)22-13-9-7-10-14-22)25-32-41-30(26(42(32)6)34(48)40(25,33(18)47)31(41)28(24)51-19(2)44)39(5,17-43)35(52-20(3)45)29(36(41)53-21(4)46)55-38(50)23-15-11-8-12-16-23/h7-17,24-36,47-48H,1H2,2-6H3/t24-,25+,26+,27+,28+,29-,30+,31+,32+,33-,34+,35-,36+,39-,40-,41+/m0/s1
InChIKey: WZYFCAODPISKSR-CHMAJFASSA-N
Reference
Diterpenoid Alkaloids from <i>Delphinium majus</i>
PubChem CID: 163106519
LOTUS: LTS0213257
Source
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Properties Information
Molecule Weight: 757.7890000000004
TPSA？: 192.27
MolLogP？: 1.9041
Number of H-Donors: 2
Number of H-Acceptors: 14
RingCount: 10
Activities Information
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