Norcassaidide; 3-Ac

AlkaPlorer ID: AK308101

Synonym: Norcassaidide 3-acetate

IUPAC Name: None

Structure

SMILES: CC(=O)OC1CCC2(C)C3CC/C(=C/C(=O)N(C)CCO)C(C)C3C(O)CC2C1(C)C

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InChI: InChI=1S/C25H41NO5/c1-15-17(13-22(30)26(6)11-12-27)7-8-18-23(15)19(29)14-20-24(3,4)21(31-16(2)28)9-10-25(18,20)5/h13,15,18-21,23,27,29H,7-12,14H2,1-6H3/b17-13-

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InChIKey: OYEDMBPKXCONKF-LGMDPLHJSA-N

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Reference

Source

Properties Information

Molecule Weight: 435.60500000000025

TPSA: 87.07000000000001

MolLogP: 3.164600000000001

Number of H-Donors: 2

Number of H-Acceptors: 5

RingCount: 3

Activities Information

Organism Target Name Standard Type Standard Value Standard Units doi

Metabolism Information