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name Structure Reference Source Properties Activities Metabolism

(1'S,2'S,3S,7'S,9'S)-2'-hydroxy-6-methoxy-1,5'-dimethyl-2-oxo-4'-oxa-12'-azaspiro[indole-3,10'-tricyclo[7.2.1.0²,⁷]dodecan]-5'-ene-6'-carbaldehyde

AlkaPlorer ID: AK003297

Synonym: None

IUPAC Name: (1S,2S,7S,9S,10S)-2-hydroxy-6'-methoxy-1',5-dimethyl-2'-oxospiro[4-oxa-12-azatricyclo[7.2.1.02,7]dodec-5-ene-10,3'-indole]-6-carbaldehyde

Structure

SMILES: COC1=CC=C2C(=C1)N(C)C(=O)[C@@]21C[C@@H]2N[C@H]1C[C@H]1C(C=O)=C(C)OC[C@@]21O

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InChI: InChI=1S/C21H24N2O5/c1-11-13(9-24)15-7-17-20(8-18(22-17)21(15,26)10-28-11)14-5-4-12(27-3)6-16(14)23(2)19(20)25/h4-6,9,15,17-18,22,26H,7-8,10H2,1-3H3/t15-,17-,18-,20-,21-/m0/s1

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InChIKey: OLVSVPOPXGQLBV-OMBLBEMTSA-N

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Source

Species Genus Family Order Class Phylum Kingdom Domain
Alstonia macrophylla Alstonia Apocynaceae Gentianales Magnoliopsida Streptophyta Viridiplantae Eukaryota

Properties Information

Molecule Weight: 384.4320000000002

TPSA？: 88.10000000000001

MolLogP？: 0.8939999999999997

Number of H-Donors: 2

Number of H-Acceptors: 6

RingCount: 5

Activities Information

Organism Target Name Standard Type Standard Value Standard Units doi

Metabolism Information