anthoroisine I

AlkaPlorer ID: AK011277

Synonym: None

IUPAC Name: None

Structure

SMILES: C[C@@]12C[C@H](OC(C)=O)C[C@]34[C@]1([H])[C@@H]5C[C@]6(C7)[C@@]3([H])C[C@H](C(OC(C(C)C)=O)[C@H]6c4(O)n5C2)C7=C

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InChI: InChI=1S/C26H35NO5/c1-12(2)22(29)32-19-16-6-18-24(7-13(16)3)10-17-20-23(5)8-15(31-14(4)28)9-25(18,20)26(30,21(19)24)27(17)11-23/h12,15-21,30H,3,6-11H2,1-2,4-5H3/t15-,16-,17-,18+,19?,20+,21+,23-,24+,25+,26?/m0/s1

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InChIKey: LGZJWMNIPUAQNJ-VATWJCMCSA-N

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Source

Species Genus Family Order Class Phylum Kingdom Domain
Incarvillea arguta Incarvillea Bignoniaceae Lamiales Magnoliopsida Streptophyta Viridiplantae Eukaryota

Properties Information

Molecule Weight: 441.56800000000027

TPSA: 76.07

MolLogP: 2.890900000000001

Number of H-Donors: 1

Number of H-Acceptors: 6

RingCount: 9

Activities Information

Organism Target Name Standard Type Standard Value Standard Units doi

Metabolism Information