Caribine

AlkaPlorer ID: AK015852

Synonym: '', 'Caribine'

IUPAC Name: (1R,17S,22S,23S)-5,7-dioxa-12,21-diazahexacyclo[10.10.1.02,10.04,8.015,23.017,22]tricosa-2,4(8),9,15-tetraen-14-ol

Structure

SMILES: OC1CN2CC3=CC4=C(C=C3[C@@H]3[C@H]5NCCC[C@H]5C=C1[C@H]32)OCO4

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InChI: InChI=1S/C19H22N2O3/c22-14-8-21-7-11-5-15-16(24-9-23-15)6-12(11)17-18-10(2-1-3-20-18)4-13(14)19(17)21/h4-6,10,14,17-20,22H,1-3,7-9H2/t10-,14?,17+,18-,19+/m0/s1

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InChIKey: YZJARFWVCIXVDT-DVORTUFPSA-N

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Reference

PubChem CID: 441590

CAS: 74483-60-6

NPASS: NPC158067

Properties Information

Molecule Weight: 326.3960000000001

TPSA: 53.96000000000001

MolLogP: 1.3657999999999997

Number of H-Donors: 2

Number of H-Acceptors: 5

RingCount: 6

Activities Information

Organism Target Name Standard Type Standard Value Standard Units doi

Metabolism Information